4-(3,4-dimethoxyphenyl)-4-oxidanylidene-N-(5-piperidin-1-ylisoquinolin-8-yl)butanamide

Systemtic Name: 4-(3,4-dimethoxyphenyl)-4-oxidanylidene-N-(5-piperidin-1-ylisoquinolin-8-yl)butanamide Openeye Name: 4-(3,4-dimethoxyphenyl)-4-oxo-N-[5-(1-piperidyl)-8-isoquinolyl]butanamide CAS Name: 4-(3,4-dimethoxyphenyl)-4-oxo-N-[5-(1-piperidinyl)-8-isoquinolinyl]butanamide IUPAC Name: 4-(3,4-dimethoxyphenyl)-4-oxo-N-(5-piperidin-1-ylisoquinolin-8-yl)butanamide Traditional Name: 4-(3,4-dimethoxyphenyl)-4-keto-N-(5-piperidino-8-isoquinolyl)butyramide Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CCC(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CCC(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4)OC

InChI

InChI=1S/C26H29N3O4/c1-32-24-10-6-18(16-25(24)33-2)23(30)9-11-26(31)28-21-7-8-22(29-14-4-3-5-15-29)19-12-13-27-17-20(19)21/h6-8,10,12-13,16-17H,3-5,9,11,14-15H2,1-2H3,(H,28,31)