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

Systemtic Name: 6,7-dimethoxy-2-[[1-(3-naphthalen-2-ylpropyl)azocan-3-yl]methyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 6,7-dimethoxy-2-[[1-[3-(2-naphthyl)propyl]azocan-3-yl]methyl]-3,4-dihydroisoquinolin-1-one CAS Name: 6,7-dimethoxy-2-[[1-[3-(2-naphthalenyl)propyl]-3-azocanyl]methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 6,7-dimethoxy-2-[[1-(3-naphthalen-2-ylpropyl)azocan-3-yl]methyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 6,7-dimethoxy-2-[[1-[3-(2-naphthyl)propyl]azocan-3-yl]methyl]-3,4-dihydroisocarbostyril Formula: C32H40N2O3 MolecularWeight: 500.6716

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN(C2=O)CC3CCCCCN(C3)CCCC4=CC5=CC=CC=C5C=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN(C2=O)CC3CCCCCN(C3)CCCC4=CC5=CC=CC=C5C=C4)OC

InChI

InChI=1S/C32H40N2O3/c1-36-30-20-28-15-18-34(32(35)29(28)21-31(30)37-2)23-25-9-4-3-7-16-33(22-25)17-8-10-24-13-14-26-11-5-6-12-27(26)19-24/h5-6,11-14,19-21,25H,3-4,7-10,15-18,22-23H2,1-2H3