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

Systemtic Name: 6,7-dimethoxy-2-[[1-(pyridin-4-ylmethyl)piperidin-3-yl]methyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 6,7-dimethoxy-2-[[1-(4-pyridylmethyl)-3-piperidyl]methyl]-3,4-dihydroisoquinolin-1-one CAS Name: 6,7-dimethoxy-2-[[1-(pyridin-4-ylmethyl)-3-piperidinyl]methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 6,7-dimethoxy-2-[[1-(pyridin-4-ylmethyl)piperidin-3-yl]methyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 6,7-dimethoxy-2-[[1-(4-pyridylmethyl)-3-piperidyl]methyl]-3,4-dihydroisocarbostyril Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN(C2=O)CC3CCCN(C3)CC4=CC=NC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN(C2=O)CC3CCCN(C3)CC4=CC=NC=C4)OC

InChI

InChI=1S/C23H29N3O3/c1-28-21-12-19-7-11-26(23(27)20(19)13-22(21)29-2)16-18-4-3-10-25(15-18)14-17-5-8-24-9-6-17/h5-6,8-9,12-13,18H,3-4,7,10-11,14-16H2,1-2H3