Vitas-M small molecule compound
(2E)-3-(4-chloro-3-nitrophenyl)-N-(1,2-dihydroacenaphthylen-5-yl)prop-2-enamide
Catalog ID
STK104878
SMILES O=C(Nc1ccc2c3c1cccc3CC2)/C=C/c1ccc(c(c1)[N+](=O)[O-])Cl
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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 C21H15ClN2O3 MW 378.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15ClN2O3/c22-17-9-4-13(12-19(17)24(26)27)5-11-20(25)23-18-10-8-15-7-6-14-2-1-3-16(18)21(14)15/h1-5,8-12H,6-7H2,(H,23,25)/b11-5+InChIKey
DCBSELHWTKVCTE-VZUCSPMQSA-NSynonyms
(2E)3(4CHLORO3NITROPHENYL)N(12DIHYDROACENAPHTHYLEN5YL)PROP2ENAMIDE
(E)3(4CHLORO3NITROPHENYL)N(12DIHYDROACENAPHTHYLEN5YL)PROP2ENAMIDE
C1CC2=CC=CC3=C(C=CC1=C23)NC(=O)C=CC4=CC(=C(C=C4)Cl)(N+)(=O)(O)
InChI=1SC21H15ClN2O3c22179413(1219(17)24(26)27)51120(25)231810815761421316(18)21(14)15h15812H67H2(H2325)b115+
MFCD03060424
O=C(Nc1ccc2c3c1cccc3CC2)C=Cc1ccc(c(c1)(N+)(=O)(O))Cl
ZINC000001164588
ZINC01164588
ZINC1164588
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