6,7-dimethyl-2-[[1-(3-naphthalen-2-ylpropyl)piperidin-3-yl]methyl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 6,7-dimethyl-2-[[1-(3-naphthalen-2-ylpropyl)piperidin-3-yl]methyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 6,7-dimethyl-2-[[1-[3-(2-naphthyl)propyl]-3-piperidyl]methyl]-3,4-dihydroisoquinolin-1-one CAS Name: 6,7-dimethyl-2-[[1-[3-(2-naphthalenyl)propyl]-3-piperidinyl]methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 6,7-dimethyl-2-[[1-(3-naphthalen-2-ylpropyl)piperidin-3-yl]methyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 6,7-dimethyl-2-[[1-[3-(2-naphthyl)propyl]-3-piperidyl]methyl]-3,4-dihydroisocarbostyril Formula: C30H36N2O MolecularWeight: 440.61964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CCN(C2=O)CC3CCCN(C3)CCCC4=CC5=CC=CC=C5C=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)CCN(C2=O)CC3CCCN(C3)CCCC4=CC5=CC=CC=C5C=C4)C

InChI

InChI=1S/C30H36N2O/c1-22-17-28-13-16-32(30(33)29(28)18-23(22)2)21-25-8-6-15-31(20-25)14-5-7-24-11-12-26-9-3-4-10-27(26)19-24/h3-4,9-12,17-19,25H,5-8,13-16,20-21H2,1-2H3