1-[1-(3,4-dimethoxyphenyl)-2-piperidin-1-yl-ethyl]-6,7-dimethoxy-isoquinoline

Systemtic Name: 1-[1-(3,4-dimethoxyphenyl)-2-piperidin-1-yl-ethyl]-6,7-dimethoxy-isoquinoline Openeye Name: 1-[1-(3,4-dimethoxyphenyl)-2-(1-piperidyl)ethyl]-6,7-dimethoxy-isoquinoline CAS Name: 1-[1-(3,4-dimethoxyphenyl)-2-(1-piperidinyl)ethyl]-6,7-dimethoxyisoquinoline IUPAC Name: 1-[1-(3,4-dimethoxyphenyl)-2-piperidin-1-ylethyl]-6,7-dimethoxyisoquinoline Traditional Name: 1-[1-(3,4-dimethoxyphenyl)-2-piperidino-ethyl]-6,7-dimethoxy-isoquinoline Formula: C26H32N2O4 MolecularWeight: 436.54328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CN2CCCCC2)C3=NC=CC4=CC(=C(C=C43)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CN2CCCCC2)C3=NC=CC4=CC(=C(C=C43)OC)OC)OC

InChI

InChI=1S/C26H32N2O4/c1-29-22-9-8-18(14-23(22)30-2)21(17-28-12-6-5-7-13-28)26-20-16-25(32-4)24(31-3)15-19(20)10-11-27-26/h8-11,14-16,21H,5-7,12-13,17H2,1-4H3