Benzoic acid, 2-[3-[2,6-difluoro-4-(1H-pyrazol-4-yl)phenyl]-3-oxo-1-propen-1-...
C23H16F2N4O3.Na
2519537-70-1 Copyright (C) 2024 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  33 35 0 0 0
M  V30 BEGIN ATOM
M  V30 1 C 4.6200 10.8437 0.0 0
M  V30 2 C 6.1600 10.8437 0.0 0
M  V30 3 C 6.9300 12.1773 0.0 0
M  V30 4 O 6.1600 13.5111 0.0 0
M  V30 5 C 4.9772 1.5400 0.0 0
M  V30 6 C 1.5400 10.8437 0.0 0
M  V30 7 O 0.0000 10.8437 0.0 0
M  V30 8 O 2.3100 12.1773 0.0 0
M  V30 9 F 8.4700 14.8447 0.0 0
M  V30 10 F 8.4700 9.5100 0.0 0
M  V30 11 C 3.8500 6.8426 0.0 0
M  V30 12 C 4.6200 8.1764 0.0 0
M  V30 13 C 2.3100 6.8426 0.0 0
M  V30 14 C 3.8500 9.5100 0.0 0
M  V30 15 C 1.5400 8.1764 0.0 0
M  V30 16 C 2.3100 9.5100 0.0 0
M  V30 17 C 4.6200 5.5089 0.0 0
M  V30 18 C 6.1516 5.3480 0.0 0
M  V30 19 C 3.9935 4.1021 0.0 0
M  V30 20 N 6.4717 3.8415 0.0 0
M  V30 21 N 5.1381 3.0715 0.0 0
M  V30 22 C 8.4700 12.1773 0.0 0
M  V30 23 C 9.2400 13.5111 0.0 0
M  V30 24 C 9.2400 10.8437 0.0 0
M  V30 25 C 10.7801 13.5111 0.0 0
M  V30 26 C 10.7801 10.8437 0.0 0
M  V30 27 C 11.5501 12.1773 0.0 0
M  V30 28 C 13.0901 12.1773 0.0 0
M  V30 29 C 13.9953 13.4233 0.0 0
M  V30 30 C 13.9953 10.9314 0.0 0
M  V30 31 N 15.4598 12.9473 0.0 0
M  V30 32 N 15.4598 11.4073 0.0 0
M  V30 33 Na 7.7299 0.0000 0.0 0 VAL=-1
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 2 1 2 CFG=2
M  V30 2 1 1 14
M  V30 3 1 2 3
M  V30 4 2 3 4
M  V30 5 1 3 22
M  V30 6 1 5 21
M  V30 7 1 6 7
M  V30 8 2 6 8
M  V30 9 1 6 16
M  V30 10 1 9 23
M  V30 11 1 10 24
M  V30 12 2 11 12
M  V30 13 1 11 13
M  V30 14 1 11 17
M  V30 15 1 12 14
M  V30 16 2 13 15
M  V30 17 2 14 16
M  V30 18 1 15 16
M  V30 19 1 17 18
M  V30 20 2 17 19
M  V30 21 2 18 20
M  V30 22 1 19 21
M  V30 23 1 20 21
M  V30 24 2 22 23
M  V30 25 1 22 24
M  V30 26 1 23 25
M  V30 27 2 24 26
M  V30 28 2 25 27
M  V30 29 1 26 27
M  V30 30 1 27 28
M  V30 31 1 28 29
M  V30 32 2 28 30
M  V30 33 2 29 31
M  V30 34 1 30 32
M  V30 35 1 31 32
M  V30 END BOND
M  V30 END CTAB
M  END
> <cas.rn>
2519537-70-1

> <cas.index.name>
Benzoic acid, 2-[3-[2,6-difluoro-4-(1H-pyrazol-4-yl)phenyl]-3-oxo-1-propen-1-yl]-4-(1-methyl-1H-pyrazol-4-yl)-, sodium salt (1:1)

> <molecular.formula>
C23H16F2N4O3.Na

> <molecular.weight>
457.39

$$$$
