ethyl 4-[2-(5-methoxy-1-oxidanylidene-isoquinolin-2-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(5-methoxy-1-oxidanylidene-isoquinolin-2-yl)ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(5-methoxy-1-oxo-2-isoquinolyl)acetyl]amino]benzoate CAS Name: 4-[[2-(5-methoxy-1-oxo-2-isoquinolinyl)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(5-methoxy-1-oxoisoquinolin-2-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(1-keto-5-methoxy-2-isoquinolyl)acetyl]amino]benzoic acid ethyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=CC3=C(C2=O)C=CC=C3OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=CC3=C(C2=O)C=CC=C3OC

InChI

InChI=1S/C21H20N2O5/c1-3-28-21(26)14-7-9-15(10-8-14)22-19(24)13-23-12-11-16-17(20(23)25)5-4-6-18(16)27-2/h4-12H,3,13H2,1-2H3,(H,22,24)