2-[[1-[2-(6,7-dimethoxyisoquinolin-4-yl)ethyl]piperidin-3-yl]methyl]-5,6-dimethoxy-3H-isoindol-1-one

Systemtic Name: 2-[[1-[2-(6,7-dimethoxyisoquinolin-4-yl)ethyl]piperidin-3-yl]methyl]-5,6-dimethoxy-3H-isoindol-1-one Openeye Name: 2-[[1-[2-(6,7-dimethoxy-4-isoquinolyl)ethyl]-3-piperidyl]methyl]-5,6-dimethoxy-isoindolin-1-one CAS Name: 2-[[1-[2-(6,7-dimethoxy-4-isoquinolinyl)ethyl]-3-piperidinyl]methyl]-5,6-dimethoxy-3H-isoindol-1-one IUPAC Name: 2-[[1-[2-(6,7-dimethoxyisoquinolin-4-yl)ethyl]piperidin-3-yl]methyl]-5,6-dimethoxy-3H-isoindol-1-one Traditional Name: 2-[[1-[2-(6,7-dimethoxy-4-isoquinolyl)ethyl]-3-piperidyl]methyl]-5,6-dimethoxy-isoindolin-1-one Formula: C29H35N3O5 MolecularWeight: 505.6053

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CN(C2=O)CC3CCCN(C3)CCC4=CN=CC5=CC(=C(C=C54)OC)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CN(C2=O)CC3CCCN(C3)CCC4=CN=CC5=CC(=C(C=C54)OC)OC)OC

InChI

InChI=1S/C29H35N3O5/c1-34-25-10-21-15-30-14-20(23(21)12-27(25)36-3)7-9-31-8-5-6-19(16-31)17-32-18-22-11-26(35-2)28(37-4)13-24(22)29(32)33/h10-15,19H,5-9,16-18H2,1-4H3