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

Systemtic Name: 6,7-dimethyl-2-[3-[1-(2-naphthalen-1-ylethyl)piperidin-3-yl]propyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 6,7-dimethyl-2-[3-[1-[2-(1-naphthyl)ethyl]-3-piperidyl]propyl]-3,4-dihydroisoquinolin-1-one CAS Name: 6,7-dimethyl-2-[3-[1-[2-(1-naphthalenyl)ethyl]-3-piperidinyl]propyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 6,7-dimethyl-2-[3-[1-(2-naphthalen-1-ylethyl)piperidin-3-yl]propyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 6,7-dimethyl-2-[3-[1-[2-(1-naphthyl)ethyl]-3-piperidyl]propyl]-3,4-dihydroisocarbostyril Formula: C31H38N2O MolecularWeight: 454.64622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CCN(C2=O)CCCC3CCCN(C3)CCC4=CC=CC5=CC=CC=C54)C

Isomeric SMILES

CC1=C(C=C2C(=C1)CCN(C2=O)CCCC3CCCN(C3)CCC4=CC=CC5=CC=CC=C54)C

InChI

InChI=1S/C31H38N2O/c1-23-20-28-15-19-33(31(34)30(28)21-24(23)2)17-7-9-25-8-6-16-32(22-25)18-14-27-12-5-11-26-10-3-4-13-29(26)27/h3-5,10-13,20-21,25H,6-9,14-19,22H2,1-2H3