Vitas-M small molecule compound
(2E)-N-(3,5-dimethylphenyl)-3-(4-nitrophenyl)prop-2-enamide
Catalog ID
STK414133
SMILES O=C(Nc1cc(C)cc(c1)C)/C=C/c1ccc(cc1)[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 C17H16N2O3 MW 296.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O3/c1-12-9-13(2)11-15(10-12)18-17(20)8-5-14-3-6-16(7-4-14)19(21)22/h3-11H,1-2H3,(H,18,20)/b8-5+InChIKey
FUBQWMULWXOCHR-VMPITWQZSA-NSynonyms
(2E)N(35dimethylphenyl)3(4nitrophenyl)prop2enamide
(E)N(35DIMETHYLPHENYL)3(4NITROPHENYL)PROP2ENAMIDE
CC1=CC(=CC(=C1)NC(=O)C=CC2=CC=C(C=C2)(N+)(=O)(O))C
InChI=1SC17H16N2O3c112913(2)1115(1012)1817(20)85143616(7414)19(21)22h311H12H3(H1820)b85+
MFCD01187502
O=C(Nc1cc(C)cc(c1)C)C=Cc1ccc(cc1)(N+)(=O)(O)
ZINC000003565987
ZINC03565987
ZINC3565987
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