ethyl 2-[2-(1-oxidanylideneisoquinolin-2-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 2-[2-(1-oxidanylideneisoquinolin-2-yl)ethanoylamino]benzoate Openeye Name: ethyl 2-[[2-(1-oxo-2-isoquinolyl)acetyl]amino]benzoate CAS Name: 2-[[1-oxo-2-(1-oxo-2-isoquinolinyl)ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-(1-oxoisoquinolin-2-yl)acetyl]amino]benzoate Traditional Name: 2-[[2-(1-keto-2-isoquinolyl)acetyl]amino]benzoic acid ethyl ester Formula: C20H18N2O4 MolecularWeight: 350.36792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)CN2C=CC3=CC=CC=C3C2=O

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)CN2C=CC3=CC=CC=C3C2=O

InChI

InChI=1S/C20H18N2O4/c1-2-26-20(25)16-9-5-6-10-17(16)21-18(23)13-22-12-11-14-7-3-4-8-15(14)19(22)24/h3-12H,2,13H2,1H3,(H,21,23)