6,7-dimethyl-2-[[1-(2-naphthalen-2-ylethyl)azocan-3-yl]methyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6,7-dimethyl-2-[[1-(2-naphthalen-2-ylethyl)azocan-3-yl]methyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 6,7-dimethyl-2-[[1-[2-(2-naphthyl)ethyl]azocan-3-yl]methyl]-3,4-dihydro-1H-isoquinoline CAS Name: 6,7-dimethyl-2-[[1-[2-(2-naphthalenyl)ethyl]-3-azocanyl]methyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 6,7-dimethyl-2-[[1-(2-naphthalen-2-ylethyl)azocan-3-yl]methyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 6,7-dimethyl-2-[[1-[2-(2-naphthyl)ethyl]azocan-3-yl]methyl]-3,4-dihydro-1H-isoquinoline Formula: C31H40N2 MolecularWeight: 440.6627

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2CN(CCC2=C1)CC3CCCCCN(C3)CCC4=CC5=CC=CC=C5C=C4)C

Isomeric SMILES

CC1=C(C=C2CN(CCC2=C1)CC3CCCCCN(C3)CCC4=CC5=CC=CC=C5C=C4)C

InChI

InChI=1S/C31H40N2/c1-24-18-30-14-17-33(23-31(30)19-25(24)2)22-27-8-4-3-7-15-32(21-27)16-13-26-11-12-28-9-5-6-10-29(28)20-26/h5-6,9-12,18-20,27H,3-4,7-8,13-17,21-23H2,1-2H3