Vitas-M small molecule compound
(2E)-2-(4-chlorophenyl)-3-(4-methoxy-3-nitrophenyl)prop-2-enenitrile
Catalog ID
STK201103
SMILES N#C/C(=C/c1ccc(c(c1)[N+](=O)[O-])OC)/c1ccc(cc1)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 C16H11ClN2O3 MW 314.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11ClN2O3/c1-22-16-7-2-11(9-15(16)19(20)21)8-13(10-18)12-3-5-14(17)6-4-12/h2-9H,1H3/b13-8-InChIKey
QGDCTWXKVWDYDX-JYRVWZFOSA-NSynonyms
(2E)2(4CHLOROPHENYL)3(4METHOXY3NITROPHENYL)PROP2ENENITRILE
(E)2(4CHLOROPHENYL)3(4METHOXY3NITROPHENYL)PROP2ENENITRILE
COC1=C(C=C(C=C1)C=C(C#N)C2=CC=C(C=C2)Cl)(N+)(=O)(O)
InChI=1SC16H11ClN2O3c122167211(915(16)19(20)21)813(1018)123514(17)6412h29H1H3b138
MFCD05988029
N#CC(=Cc1ccc(c(c1)(N+)(=O)(O))OC)c1ccc(cc1)Cl
ZINC000012364158
ZINC12364158
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