Vitas-M small molecule compound
(2Z)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)-1-(3-methyl-4-nitrophenyl)ethanone
Catalog ID
STL058251
SMILES COc1cc2CCN/C(=C\C(=O)c3ccc(c(c3)C)[N+](=O)[O-])/c2cc1OC
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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 C20H20N2O5 MW 368.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O5/c1-12-8-14(4-5-17(12)22(24)25)18(23)11-16-15-10-20(27-3)19(26-2)9-13(15)6-7-21-16/h4-5,8-11,21H,6-7H2,1-3H3/b16-11-InChIKey
FBQHBJMNMQIFQG-WJDWOHSUSA-NSynonyms
892620-92-7(2Z)2(67dimethoxy34dihydro2Hisoquinolin1ylidene)1(3methyl4nitrophenyl)ethanone
(2Z)2(67dimethoxy34dihydroisoquinolin1(2H)ylidene)1(3methyl4nitrophenyl)ethanone
(Z)2(67dimethoxy34dihydroisoquinolin1(2H)ylidene)1(3methyl4nitrophenyl)ethanone
892620927
CC1=C(C=CC(=C1)C(=O)C=C2C3=CC(=C(C=C3CCN2)OC)OC)(N+)(=O)(O)
COc1cc2CCNC(=CC(=O)c3ccc(c(c3)C)(N+)(=O)(O))c2cc1OC
InChI=1SC20H20N2O5c112814(4517(12)22(24)25)18(23)1116151020(273)19(262)913(15)672116h4581121H67H213H3b1611
MFCD06774442
ZINC000005245672
ZINC05245672
ZINC5245672
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