Vitas-M small molecule compound
(2E)-N-(heptan-2-yl)-3-(4-nitrophenyl)prop-2-enamide
Catalog ID
STK447542
SMILES CCCCCC(NC(=O)/C=C/c1ccc(cc1)[N+](=O)[O-])C
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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 C16H22N2O3 MW 290.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O3/c1-3-4-5-6-13(2)17-16(19)12-9-14-7-10-15(11-8-14)18(20)21/h7-13H,3-6H2,1-2H3,(H,17,19)/b12-9+InChIKey
CDLBHTDMEJGALB-FMIVXFBMSA-NSynonyms
(2E)N(heptan2yl)3(4nitrophenyl)prop2enamide
(2E)N(METHYLHEXYL)3(4NITROPHENYL)PROP2ENAMIDE
(E)NHEPTAN2YL3(4NITROPHENYL)PROP2ENAMIDE
CCCCCC(C)NC(=O)C=CC1=CC=C(C=C1)(N+)(=O)(O)
CCCCCC(NC(=O)C=Cc1ccc(cc1)(N+)(=O)(O))C
InChI=1SC16H22N2O3c1345613(2)1716(19)1291471015(11814)18(20)21h713H36H212H3(H1719)b129+
MFCD00419725
ZINC000003154998
ZINC000003155000
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