ethyl 4-[(1-oxidanylidene-2H-isoquinolin-3-yl)amino]benzoate

Systemtic Name: ethyl 4-[(1-oxidanylidene-2H-isoquinolin-3-yl)amino]benzoate Openeye Name: ethyl 4-[(1-oxo-2H-isoquinolin-3-yl)amino]benzoate CAS Name: 4-[(1-oxo-2H-isoquinolin-3-yl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(1-oxo-2H-isoquinolin-3-yl)amino]benzoate Traditional Name: 4-[(1-keto-2H-isoquinolin-3-yl)amino]benzoic acid ethyl ester Formula: C18H16N2O3 MolecularWeight: 308.33124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=CC3=CC=CC=C3C(=O)N2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=CC3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C18H16N2O3/c1-2-23-18(22)12-7-9-14(10-8-12)19-16-11-13-5-3-4-6-15(13)17(21)20-16/h3-11H,2H2,1H3,(H2,19,20,21)