Vitas-M small molecule compound
methyl 2-{[(2E)-3-(3-nitrophenyl)prop-2-enoyl]amino}benzoate
Catalog ID
STK395763
SMILES COC(=O)c1ccccc1NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-]
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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 C17H14N2O5 MW 326.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O5/c1-24-17(21)14-7-2-3-8-15(14)18-16(20)10-9-12-5-4-6-13(11-12)19(22)23/h2-11H,1H3,(H,18,20)/b10-9+InChIKey
CTMDETQGXKWIKG-MDZDMXLPSA-NSynonyms
COC(=O)C1=CC=CC=C1NC(=O)C=CC2=CC(=CC=C2)(N+)(=O)(O)
COC(=O)c1ccccc1NC(=O)C=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC17H14N2O5c12417(21)14723815(14)1816(20)1091254613(1112)19(22)23h211H1H3(H1820)b109+
methyl2(((2E)3(3nitrophenyl)prop2enoyl)amino)benzoate
METHYL2(((E)3(3NITROPHENYL)PROP2ENOYL)AMINO)BENZOATE
METHYL2((2E)3(3NITROPHENYL)PROP2ENOYLAMINO)BENZOATE
MFCD00705396
TRANS3NITROCINNAMICACIDN(2METHOXYCARBONYLPHENYL)AMIDE
ZINC000000063888
ZINC00063888
ZINC63888
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