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

Systemtic Name: 1-[6,7-dimethoxy-2-(2-methylpropyl)-1-oxidanylidene-isoquinolin-4-yl]carbonylpiperidine-4-carboxamide Openeye Name: 1-(2-isobutyl-6,7-dimethoxy-1-oxo-isoquinoline-4-carbonyl)piperidine-4-carboxamide CAS Name: 1-[[6,7-dimethoxy-2-(2-methylpropyl)-1-oxo-4-isoquinolinyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[6,7-dimethoxy-2-(2-methylpropyl)-1-oxoisoquinoline-4-carbonyl]piperidine-4-carboxamide Traditional Name: 1-(2-isobutyl-1-keto-6,7-dimethoxy-isoquinoline-4-carbonyl)isonipecotamide Formula: C22H29N3O5 MolecularWeight: 415.48276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)N3CCC(CC3)C(=O)N

Isomeric SMILES

CC(C)CN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C22H29N3O5/c1-13(2)11-25-12-17(22(28)24-7-5-14(6-8-24)20(23)26)15-9-18(29-3)19(30-4)10-16(15)21(25)27/h9-10,12-14H,5-8,11H2,1-4H3,(H2,23,26)