N-[2-(2-hydroxyethyl)-1-oxidanylidene-isoquinolin-5-yl]-2-phenyl-butanamide

Systemtic Name: N-[2-(2-hydroxyethyl)-1-oxidanylidene-isoquinolin-5-yl]-2-phenyl-butanamide Openeye Name: N-[2-(2-hydroxyethyl)-1-oxo-5-isoquinolyl]-2-phenyl-butanamide CAS Name: N-[2-(2-hydroxyethyl)-1-oxo-5-isoquinolinyl]-2-phenylbutanamide IUPAC Name: N-[2-(2-hydroxyethyl)-1-oxoisoquinolin-5-yl]-2-phenylbutanamide Traditional Name: N-[2-(2-hydroxyethyl)-1-keto-5-isoquinolyl]-2-phenyl-butyramide Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=CC=CC3=C2C=CN(C3=O)CCO

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=CC=CC3=C2C=CN(C3=O)CCO

InChI

InChI=1S/C21H22N2O3/c1-2-16(15-7-4-3-5-8-15)20(25)22-19-10-6-9-18-17(19)11-12-23(13-14-24)21(18)26/h3-12,16,24H,2,13-14H2,1H3,(H,22,25)