6,7-dimethoxy-2-[[1-(3-naphthalen-1-yl-2-oxidanyl-propyl)pyrrolidin-3-yl]methyl]-3,4-dihydroisoquinolin-1-one hydrochloride

Systemtic Name: 6,7-dimethoxy-2-[[1-(3-naphthalen-1-yl-2-oxidanyl-propyl)pyrrolidin-3-yl]methyl]-3,4-dihydroisoquinolin-1-one hydrochloride Openeye Name: 2-[[1-[2-hydroxy-3-(1-naphthyl)propyl]pyrrolidin-3-yl]methyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-1-one hydrochloride CAS Name: 2-[[1-[2-hydroxy-3-(1-naphthalenyl)propyl]-3-pyrrolidinyl]methyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-1-one hydrochloride IUPAC Name: 2-[[1-(2-hydroxy-3-naphthalen-1-ylpropyl)pyrrolidin-3-yl]methyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-1-one hydrochloride Traditional Name: 2-[[1-[2-hydroxy-3-(1-naphthyl)propyl]pyrrolidin-3-yl]methyl]-6,7-dimethoxy-3,4-dihydroisocarbostyril hydrochloride Formula: C29H35ClN2O4 MolecularWeight: 511.0522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN(C2=O)CC3CCN(C3)CC(CC4=CC=CC5=CC=CC=C54)O)OC.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN(C2=O)CC3CCN(C3)CC(CC4=CC=CC5=CC=CC=C54)O)OC.Cl

InChI

InChI=1S/C29H34N2O4.ClH/c1-34-27-15-23-11-13-31(29(33)26(23)16-28(27)35-2)18-20-10-12-30(17-20)19-24(32)14-22-8-5-7-21-6-3-4-9-25(21)22;/h3-9,15-16,20,24,32H,10-14,17-19H2,1-2H3;1H