N-(3,4-diethoxyphenyl)-2-(1-oxidanylideneisoquinolin-2-yl)ethanamide

Systemtic Name: N-(3,4-diethoxyphenyl)-2-(1-oxidanylideneisoquinolin-2-yl)ethanamide Openeye Name: N-(3,4-diethoxyphenyl)-2-(1-oxo-2-isoquinolyl)acetamide CAS Name: N-(3,4-diethoxyphenyl)-2-(1-oxo-2-isoquinolinyl)acetamide IUPAC Name: N-(3,4-diethoxyphenyl)-2-(1-oxoisoquinolin-2-yl)acetamide Traditional Name: N-(3,4-diethoxyphenyl)-2-(1-keto-2-isoquinolyl)acetamide Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CN2C=CC3=CC=CC=C3C2=O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CN2C=CC3=CC=CC=C3C2=O)OCC

InChI

InChI=1S/C21H22N2O4/c1-3-26-18-10-9-16(13-19(18)27-4-2)22-20(24)14-23-12-11-15-7-5-6-8-17(15)21(23)25/h5-13H,3-4,14H2,1-2H3,(H,22,24)