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

Systemtic Name: 6,7-dimethoxy-2-[[1-(3-pyridin-3-ylpropyl)piperidin-3-yl]methyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 6,7-dimethoxy-2-[[1-[3-(3-pyridyl)propyl]-3-piperidyl]methyl]-3,4-dihydroisoquinolin-1-one CAS Name: 6,7-dimethoxy-2-[[1-[3-(3-pyridinyl)propyl]-3-piperidinyl]methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 6,7-dimethoxy-2-[[1-(3-pyridin-3-ylpropyl)piperidin-3-yl]methyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 6,7-dimethoxy-2-[[1-[3-(3-pyridyl)propyl]-3-piperidyl]methyl]-3,4-dihydroisocarbostyril Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN(C2=O)CC3CCCN(C3)CCCC4=CN=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN(C2=O)CC3CCCN(C3)CCCC4=CN=CC=C4)OC

InChI

InChI=1S/C25H33N3O3/c1-30-23-14-21-9-13-28(25(29)22(21)15-24(23)31-2)18-20-8-5-12-27(17-20)11-4-7-19-6-3-10-26-16-19/h3,6,10,14-16,20H,4-5,7-9,11-13,17-18H2,1-2H3