Vitas-M small molecule compound
(2E)-N-(5-chloro-2-methylphenyl)-3-(4-nitrophenyl)prop-2-enamide
Catalog ID
STL123593
SMILES O=C(Nc1cc(Cl)ccc1C)/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 C16H13ClN2O3 MW 316.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN2O3/c1-11-2-6-13(17)10-15(11)18-16(20)9-5-12-3-7-14(8-4-12)19(21)22/h2-10H,1H3,(H,18,20)/b9-5+InChIKey
MEQXXBSYAOPFEW-WEVVVXLNSA-NSynonyms
(2E)N(5chloro2methylphenyl)3(4nitrophenyl)prop2enamide
(E)N(5CHLORO2METHYLPHENYL)3(4NITROPHENYL)PROP2ENAMIDE
CC1=C(C=C(C=C1)Cl)NC(=O)C=CC2=CC=C(C=C2)(N+)(=O)(O)
InChI=1SC16H13ClN2O3c1112613(17)1015(11)1816(20)95123714(8412)19(21)22h210H1H3(H1820)b95+
MFCD01187509
O=C(Nc1cc(Cl)ccc1C)C=Cc1ccc(cc1)(N+)(=O)(O)
ZINC000000450427
ZINC00450427
ZINC450427
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