6,7-dimethoxy-2-[[1-(3-naphthalen-2-ylpropyl)pyrrolidin-3-yl]methyl]isoquinolin-1-one hydrochloride

Systemtic Name: 6,7-dimethoxy-2-[[1-(3-naphthalen-2-ylpropyl)pyrrolidin-3-yl]methyl]isoquinolin-1-one hydrochloride Openeye Name: 6,7-dimethoxy-2-[[1-[3-(2-naphthyl)propyl]pyrrolidin-3-yl]methyl]isoquinolin-1-one hydrochloride CAS Name: 6,7-dimethoxy-2-[[1-[3-(2-naphthalenyl)propyl]-3-pyrrolidinyl]methyl]-1-isoquinolinone hydrochloride IUPAC Name: 6,7-dimethoxy-2-[[1-(3-naphthalen-2-ylpropyl)pyrrolidin-3-yl]methyl]isoquinolin-1-one hydrochloride Traditional Name: 6,7-dimethoxy-2-[[1-[3-(2-naphthyl)propyl]pyrrolidin-3-yl]methyl]isocarbostyril hydrochloride Formula: C29H33ClN2O3 MolecularWeight: 493.03692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=CN(C2=O)CC3CCN(C3)CCCC4=CC5=CC=CC=C5C=C4)OC.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C=CN(C2=O)CC3CCN(C3)CCCC4=CC5=CC=CC=C5C=C4)OC.Cl

InChI

InChI=1S/C29H32N2O3.ClH/c1-33-27-17-25-12-15-31(29(32)26(25)18-28(27)34-2)20-22-11-14-30(19-22)13-5-6-21-9-10-23-7-3-4-8-24(23)16-21;/h3-4,7-10,12,15-18,22H,5-6,11,13-14,19-20H2,1-2H3;1H