3-[3-(6,7-dimethoxy-1-oxidanylidene-3,4-dihydroisoquinolin-2-yl)piperidin-1-yl]-N-(3,4-dimethoxyphenyl)propanamide

Systemtic Name: 3-[3-(6,7-dimethoxy-1-oxidanylidene-3,4-dihydroisoquinolin-2-yl)piperidin-1-yl]-N-(3,4-dimethoxyphenyl)propanamide Openeye Name: 3-[3-(6,7-dimethoxy-1-oxo-3,4-dihydroisoquinolin-2-yl)-1-piperidyl]-N-(3,4-dimethoxyphenyl)propanamide CAS Name: 3-[3-(6,7-dimethoxy-1-oxo-3,4-dihydroisoquinolin-2-yl)-1-piperidinyl]-N-(3,4-dimethoxyphenyl)propanamide IUPAC Name: 3-[3-(6,7-dimethoxy-1-oxo-3,4-dihydroisoquinolin-2-yl)piperidin-1-yl]-N-(3,4-dimethoxyphenyl)propanamide Traditional Name: N-(3,4-dimethoxyphenyl)-3-[3-(1-keto-6,7-dimethoxy-3,4-dihydroisoquinolin-2-yl)piperidino]propionamide Formula: C27H35N3O6 MolecularWeight: 497.5833

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCN2CCCC(C2)N3CCC4=CC(=C(C=C4C3=O)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CCN2CCCC(C2)N3CCC4=CC(=C(C=C4C3=O)OC)OC)OC

InChI

InChI=1S/C27H35N3O6/c1-33-22-8-7-19(15-24(22)35-3)28-26(31)10-12-29-11-5-6-20(17-29)30-13-9-18-14-23(34-2)25(36-4)16-21(18)27(30)32/h7-8,14-16,20H,5-6,9-13,17H2,1-4H3,(H,28,31)