dimethyl 2-[2-(4-oxidanylidenecinnolin-1-yl)ethanoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[2-(4-oxidanylidenecinnolin-1-yl)ethanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[1-oxo-2-(4-oxo-1-cinnolinyl)ethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-(4-ketocinnolin-1-yl)acetyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C20H17N3O6 MolecularWeight: 395.36548

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CN2C3=CC=CC=C3C(=O)C=N2

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CN2C3=CC=CC=C3C(=O)C=N2

InChI

InChI=1S/C20H17N3O6/c1-28-19(26)12-7-8-13(20(27)29-2)15(9-12)22-18(25)11-23-16-6-4-3-5-14(16)17(24)10-21-23/h3-10H,11H2,1-2H3,(H,22,25)