1-[1-(3,4-dimethoxyphenyl)-3,3-diethoxy-propyl]-6,7-dimethoxy-isoquinoline

Systemtic Name: 1-[1-(3,4-dimethoxyphenyl)-3,3-diethoxy-propyl]-6,7-dimethoxy-isoquinoline Openeye Name: 1-[1-(3,4-dimethoxyphenyl)-3,3-diethoxy-propyl]-6,7-dimethoxy-isoquinoline CAS Name: 1-[1-(3,4-dimethoxyphenyl)-3,3-diethoxypropyl]-6,7-dimethoxyisoquinoline IUPAC Name: 1-[1-(3,4-dimethoxyphenyl)-3,3-diethoxypropyl]-6,7-dimethoxyisoquinoline Traditional Name: 1-[1-(3,4-dimethoxyphenyl)-3,3-diethoxy-propyl]-6,7-dimethoxy-isoquinoline Formula: C26H33NO6 MolecularWeight: 455.54332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC(C1=CC(=C(C=C1)OC)OC)C2=NC=CC3=CC(=C(C=C32)OC)OC)OCC

Isomeric SMILES

CCOC(CC(C1=CC(=C(C=C1)OC)OC)C2=NC=CC3=CC(=C(C=C32)OC)OC)OCC

InChI

InChI=1S/C26H33NO6/c1-7-32-25(33-8-2)16-20(17-9-10-21(28-3)22(13-17)29-4)26-19-15-24(31-6)23(30-5)14-18(19)11-12-27-26/h9-15,20,25H,7-8,16H2,1-6H3