Vitas-M small molecule compound
(2E)-N-(1-hydroxy-2-methylpropan-2-yl)-3-(4-nitrophenyl)prop-2-enamide
Catalog ID
STK395073
SMILES OCC(NC(=O)/C=C/c1ccc(cc1)[N+](=O)[O-])(C)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 C13H16N2O4 MW 264.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O4/c1-13(2,9-16)14-12(17)8-5-10-3-6-11(7-4-10)15(18)19/h3-8,16H,9H2,1-2H3,(H,14,17)/b8-5+InChIKey
NJGSJCQBPHKHPB-VMPITWQZSA-NSynonyms
384376-77-6(2E)N(1hydroxy2methylpropan2yl)3(4nitrophenyl)prop2enamide
(2E)N(2HYDROXYTERTBUTYL)3(4NITROPHENYL)PROP2ENAMIDE
(E)N(1hydroxy2methylpropan2yl)3(4nitrophenyl)acrylamide
(E)N(1HYDROXY2METHYLPROPAN2YL)3(4NITROPHENYL)PROP2ENAMIDE
384376776
CC(C)(CO)NC(=O)C=CC1=CC=C(C=C1)(N+)(=O)(O)
InChI=1SC13H16N2O4c113(2916)1412(17)85103611(7410)15(18)19h3816H9H212H3(H1417)b85+
MFCD03103705
OCC(NC(=O)C=Cc1ccc(cc1)(N+)(=O)(O))(C)C
ZINC000000547726
ZINC00547726
ZINC547726
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