Vitas-M small molecule compound
(2E)-3-(3-chlorophenyl)-N-(4-methyl-2-nitrophenyl)prop-2-enamide
Catalog ID
STK440189
SMILES O=C(Nc1ccc(cc1[N+](=O)[O-])C)/C=C/c1cccc(c1)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 C16H13ClN2O3 MW 316.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN2O3/c1-11-5-7-14(15(9-11)19(21)22)18-16(20)8-6-12-3-2-4-13(17)10-12/h2-10H,1H3,(H,18,20)/b8-6+InChIKey
ZPJVKGULRNZDAK-SOFGYWHQSA-NSynonyms
(2E)3(3chlorophenyl)N(4methyl2nitrophenyl)prop2enamide
(E)3(3CHLOROPHENYL)N(4METHYL2NITROPHENYL)PROP2ENAMIDE
CC1=CC(=C(C=C1)NC(=O)C=CC2=CC(=CC=C2)Cl)(N+)(=O)(O)
InChI=1SC16H13ClN2O3c1115714(15(911)19(21)22)1816(20)861232413(17)1012h210H1H3(H1820)b86+
MFCD03397774
O=C(Nc1ccc(cc1(N+)(=O)(O))C)C=Cc1cccc(c1)Cl
ZINC000004892969
ZINC04892969
ZINC4892969
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