Vitas-M small molecule compound
4-[(1E)-2-cyano-3-methoxy-3-oxoprop-1-en-1-yl]-2-methoxyphenyl 4-nitrobenzoate
Catalog ID
STK584407
SMILES N#C/C(=C\c1ccc(c(c1)OC)OC(=O)c1ccc(cc1)[N+](=O)[O-])/C(=O)OC
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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 C19H14N2O7 MW 382.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14N2O7/c1-26-17-10-12(9-14(11-20)18(22)27-2)3-8-16(17)28-19(23)13-4-6-15(7-5-13)21(24)25/h3-10H,1-2H3/b14-9+InChIKey
NAVIOFUTDXFBAM-NTEUORMPSA-NSynonyms
469875-70-5(4((E)2cyano3methoxy3oxoprop1enyl)2methoxyphenyl)4nitrobenzoate
(E)4(2cyano3methoxy3oxoprop1en1yl)2methoxyphenyl4nitrobenzoate
4((1E)2cyano3methoxy3oxoprop1en1yl)2methoxyphenyl4nitrobenzoate
469875705
COC1=C(C=CC(=C1)C=C(C#N)C(=O)OC)OC(=O)C2=CC=C(C=C2)(N+)(=O)(O)
InChI=1SC19H14N2O7c126171012(914(1120)18(22)272)3816(17)2819(23)134615(7513)21(24)25h310H12H3b149+
METHYL(2E)2CYANO3(3METHOXY4(4NITROPHENYLCARBONYLOXY)PHENYL)PROP2ENOATE
MFCD02730363
N#CC(=Cc1ccc(c(c1)OC)OC(=O)c1ccc(cc1)(N+)(=O)(O))C(=O)OC
ZINC000000951068
ZINC00951068
ZINC951068
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