dimethyl 5-[3-(4-oxidanylidenecinnolin-1-yl)propanoyloxy]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[3-(4-oxidanylidenecinnolin-1-yl)propanoyloxy]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[3-(4-oxocinnolin-1-yl)propanoyloxy]benzene-1,3-dicarboxylate CAS Name: 5-[1-oxo-3-(4-oxo-1-cinnolinyl)propoxy]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[3-(4-oxocinnolin-1-yl)propanoyloxy]benzene-1,3-dicarboxylate Traditional Name: 5-[3-(4-ketocinnolin-1-yl)propanoyloxy]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H18N2O7 MolecularWeight: 410.37682

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)OC(=O)CCN2C3=CC=CC=C3C(=O)C=N2)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)OC(=O)CCN2C3=CC=CC=C3C(=O)C=N2)C(=O)OC

InChI

InChI=1S/C21H18N2O7/c1-28-20(26)13-9-14(21(27)29-2)11-15(10-13)30-19(25)7-8-23-17-6-4-3-5-16(17)18(24)12-22-23/h3-6,9-12H,7-8H2,1-2H3