2-(2-methoxyphenyl)-N-[2-(oxan-4-ylmethyl)-1-oxidanylidene-isoquinolin-5-yl]ethanamide

Systemtic Name: 2-(2-methoxyphenyl)-N-[2-(oxan-4-ylmethyl)-1-oxidanylidene-isoquinolin-5-yl]ethanamide Openeye Name: 2-(2-methoxyphenyl)-N-[1-oxo-2-(tetrahydropyran-4-ylmethyl)-5-isoquinolyl]acetamide CAS Name: 2-(2-methoxyphenyl)-N-[2-(4-oxanylmethyl)-1-oxo-5-isoquinolinyl]acetamide IUPAC Name: 2-(2-methoxyphenyl)-N-[2-(oxan-4-ylmethyl)-1-oxoisoquinolin-5-yl]acetamide Traditional Name: N-[1-keto-2-(tetrahydropyran-4-ylmethyl)-5-isoquinolyl]-2-(2-methoxyphenyl)acetamide Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CC(=O)NC2=CC=CC3=C2C=CN(C3=O)CC4CCOCC4

Isomeric SMILES

COC1=CC=CC=C1CC(=O)NC2=CC=CC3=C2C=CN(C3=O)CC4CCOCC4

InChI

InChI=1S/C24H26N2O4/c1-29-22-8-3-2-5-18(22)15-23(27)25-21-7-4-6-20-19(21)9-12-26(24(20)28)16-17-10-13-30-14-11-17/h2-9,12,17H,10-11,13-16H2,1H3,(H,25,27)