6,7-dimethoxy-2-[2-[1-(3-phenylmethoxypropyl)piperidin-2-yl]ethyl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 6,7-dimethoxy-2-[2-[1-(3-phenylmethoxypropyl)piperidin-2-yl]ethyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[2-[1-(3-benzyloxypropyl)-2-piperidyl]ethyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-1-one CAS Name: 6,7-dimethoxy-2-[2-[1-(3-phenylmethoxypropyl)-2-piperidinyl]ethyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 6,7-dimethoxy-2-[2-[1-(3-phenylmethoxypropyl)piperidin-2-yl]ethyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[2-[1-(3-benzoxypropyl)-2-piperidyl]ethyl]-6,7-dimethoxy-3,4-dihydroisocarbostyril Formula: C28H38N2O4 MolecularWeight: 466.61232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN(C2=O)CCC3CCCCN3CCCOCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN(C2=O)CCC3CCCCN3CCCOCC4=CC=CC=C4)OC

InChI

InChI=1S/C28H38N2O4/c1-32-26-19-23-12-16-30(28(31)25(23)20-27(26)33-2)17-13-24-11-6-7-14-29(24)15-8-18-34-21-22-9-4-3-5-10-22/h3-5,9-10,19-20,24H,6-8,11-18,21H2,1-2H3