Vitas-M small molecule compound
(2E)-3-(4-tert-butylphenyl)-N-(4-methyl-2-nitrophenyl)prop-2-enamide
Catalog ID
STK439299
SMILES O=C(Nc1ccc(cc1[N+](=O)[O-])C)/C=C/c1ccc(cc1)C(C)(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 C20H22N2O3 MW 338.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O3/c1-14-5-11-17(18(13-14)22(24)25)21-19(23)12-8-15-6-9-16(10-7-15)20(2,3)4/h5-13H,1-4H3,(H,21,23)/b12-8+InChIKey
XITQHFVFOVRMLB-XYOKQWHBSA-NSynonyms
545383-93-5(2E)3(4(TERTBUTYL)PHENYL)N(4METHYL2NITROPHENYL)PROP2ENAMIDE
(2E)3(4tertbutylphenyl)N(4methyl2nitrophenyl)prop2enamide
(E)3(4TERTBUTYLPHENYL)N(4METHYL2NITROPHENYL)PROP2ENAMIDE
3(4TERTBUTYLPHENYL)N(2NITRO4METHYLPHENYL)ACRYLAMIDE
545383935
CC1=CC(=C(C=C1)NC(=O)C=CC2=CC=C(C=C2)C(C)(C)C)(N+)(=O)(O)
InChI=1SC20H22N2O3c11451117(18(1314)22(24)25)2119(23)128156916(10715)20(23)4h513H14H3(H2123)b128+
MFCD03390503
O=C(Nc1ccc(cc1(N+)(=O)(O))C)C=Cc1ccc(cc1)C(C)(C)C
ZINC000004652301
ZINC04652301
ZINC4652301
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