Vitas-M small molecule compound

4-[(Z)-{2-[(2-chlorophenyl)carbonyl]hydrazinylidene}methyl]phenyl 3-methyl-4-nitrobenzoate

Catalog ID
STK099968
SMILES O=C(c1ccc(c(c1)C)[N+](=O)[O-])Oc1ccc(cc1)/C=N\NC(=O)c1ccccc1Cl

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C22H16ClN3O5 MW 437.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClN3O5/c1-14-12-16(8-11-20(14)26(29)30)22(28)31-17-9-6-15(7-10-17)13-24-25-21(27)18-4-2-3-5-19(18)23/h2-13H,1H3,(H,25,27)/b24-13-
InChIKey
AYXVRYQPCXRSSP-CFRMEGHHSA-N
Synonyms

(4((Z)((2CHLOROBENZOYL)HYDRAZINYLIDENE)METHYL)PHENYL)3METHYL4NITROBENZOATE
4((Z)(2((2CHLOROPHENYL)CARBONYL)HYDRAZINYLIDENE)METHYL)PHENYL3METHYL4NITROBENZOATE
CC1=C(C=CC(=C1)C(=O)OC2=CC=C(C=C2)C=NNC(=O)C3=CC=CC=C3Cl)(N+)(=O)(O)
InChI=1SC22H16ClN3O5c1141216(81120(14)26(29)30)22(28)31179615(71017)13242521(27)18423519(18)23h213H1H3(H2527)b2413
MFCD01874606
O=C(c1ccc(c(c1)C)(N+)(=O)(O))Oc1ccc(cc1)C=NNC(=O)c1ccccc1Cl
STK099968
ZINC000030735222
ZINC33957564

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Available files

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