1-[2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxidanylidene-isoquinolin-4-yl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxidanylidene-isoquinolin-4-yl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxo-isoquinoline-4-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxo-4-isoquinolinyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxoisoquinoline-4-carbonyl]piperidine-4-carboxamide Traditional Name: 1-(1-keto-6,7-dimethoxy-2-p-phenetyl-isoquinoline-4-carbonyl)isonipecotamide Formula: C26H29N3O6 MolecularWeight: 479.52496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C=C(C3=CC(=C(C=C3C2=O)OC)OC)C(=O)N4CCC(CC4)C(=O)N

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C=C(C3=CC(=C(C=C3C2=O)OC)OC)C(=O)N4CCC(CC4)C(=O)N

InChI

InChI=1S/C26H29N3O6/c1-4-35-18-7-5-17(6-8-18)29-15-21(25(31)28-11-9-16(10-12-28)24(27)30)19-13-22(33-2)23(34-3)14-20(19)26(29)32/h5-8,13-16H,4,9-12H2,1-3H3,(H2,27,30)