Vitas-M small molecule compound
methyl 4-[1-(3,4-diethoxyphenyl)-6,7-diethoxy-3-oxo-3,4-dihydroisoquinolin-2(1H)-yl]benzoate
Catalog ID
STK856211
SMILES CCOc1cc(ccc1OCC)C1N(c2ccc(cc2)C(=O)OC)C(=O)Cc2c1cc(OCC)c(c2)OCC
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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 C31H35NO7 MW 533.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H35NO7/c1-6-36-25-15-12-21(16-26(25)37-7-2)30-24-19-28(39-9-4)27(38-8-3)17-22(24)18-29(33)32(30)23-13-10-20(11-14-23)31(34)35-5/h10-17,19,30H,6-9,18H2,1-5H3InChIKey
NXRPHKBQHLWNHI-UHFFFAOYSA-NSynonyms
672886-90-7672886907
CCOC1=C(C=C(C=C1)C2C3=CC(=C(C=C3CC(=O)N2C4=CC=C(C=C4)C(=O)OC)OCC)OCC)OCC
InChI=1SC31H35NO7c163625151221(1626(25)3772)30241928(3994)27(3883)1722(24)1829(33)32(30)23131020(111423)31(34)355h10171930H6918H215H3
METHYL4(1(34DIETHOXYPHENYL)67DIETHOXY3OXO14DIHYDROISOQUINOLIN2YL)BENZOATE
methyl4(1(34diethoxyphenyl)67diethoxy3oxo34dihydroisoquinolin2(1H)yl)benzoate
MFCD03661788
ZINC000001823245
ZINC000001823246
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