Vitas-M small molecule compound
(2E)-N-(3,4-dimethylphenyl)-3-(4-nitrophenyl)prop-2-enamide
Catalog ID
STK414132
SMILES O=C(Nc1ccc(c(c1)C)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/c1-12-3-7-15(11-13(12)2)18-17(20)10-6-14-4-8-16(9-5-14)19(21)22/h3-11H,1-2H3,(H,18,20)/b10-6+InChIKey
PTHZDVRONJBODY-UXBLZVDNSA-NSynonyms
(2E)N(34dimethylphenyl)3(4nitrophenyl)prop2enamide
(E)N(34DIMETHYLPHENYL)3(4NITROPHENYL)PROP2ENAMIDE
CC1=C(C=C(C=C1)NC(=O)C=CC2=CC=C(C=C2)(N+)(=O)(O))C
InChI=1SC17H16N2O3c1123715(1113(12)2)1817(20)106144816(9514)19(21)22h311H12H3(H1820)b106+
MFCD00409592
O=C(Nc1ccc(c(c1)C)C)C=Cc1ccc(cc1)(N+)(=O)(O)
ZINC000000439073
ZINC00439073
ZINC439073
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