3-ethoxy-N-[1-oxidanylidene-2-(1-oxidanylpropan-2-yl)isoquinolin-5-yl]benzamide

Systemtic Name: 3-ethoxy-N-[1-oxidanylidene-2-(1-oxidanylpropan-2-yl)isoquinolin-5-yl]benzamide Openeye Name: 3-ethoxy-N-[2-(2-hydroxy-1-methyl-ethyl)-1-oxo-5-isoquinolyl]benzamide CAS Name: 3-ethoxy-N-[2-(1-hydroxypropan-2-yl)-1-oxo-5-isoquinolinyl]benzamide IUPAC Name: 3-ethoxy-N-[2-(1-hydroxypropan-2-yl)-1-oxoisoquinolin-5-yl]benzamide Traditional Name: 3-ethoxy-N-[2-(2-hydroxy-1-methyl-ethyl)-1-keto-5-isoquinolyl]benzamide Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(=O)NC2=CC=CC3=C2C=CN(C3=O)C(C)CO

Isomeric SMILES

CCOC1=CC=CC(=C1)C(=O)NC2=CC=CC3=C2C=CN(C3=O)C(C)CO

InChI

InChI=1S/C21H22N2O4/c1-3-27-16-7-4-6-15(12-16)20(25)22-19-9-5-8-18-17(19)10-11-23(21(18)26)14(2)13-24/h4-12,14,24H,3,13H2,1-2H3,(H,22,25)