methyl 1-oxidanylidene-2-pyrrolidin-3-yl-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate hydrochloride

Systemtic Name: methyl 1-oxidanylidene-2-pyrrolidin-3-yl-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate hydrochloride Openeye Name: methyl 1-oxo-2-pyrrolidin-3-yl-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate hydrochloride CAS Name: 1-oxo-2-(3-pyrrolidinyl)-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester hydrochloride IUPAC Name: methyl 1-oxo-2-pyrrolidin-3-yl-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate hydrochloride Traditional Name: 1-keto-2-pyrrolidin-3-yl-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester hydrochloride Formula: C24H27ClN2O6 MolecularWeight: 474.93398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=CC=CC=C32)C4CCNC4)C(=O)OC.Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=CC=CC=C32)C4CCNC4)C(=O)OC.Cl

InChI

InChI=1S/C24H26N2O6.ClH/c1-29-18-11-14(12-19(30-2)22(18)31-3)20-16-7-5-6-8-17(16)23(27)26(15-9-10-25-13-15)21(20)24(28)32-4;/h5-8,11-12,15,25H,9-10,13H2,1-4H3;1H