(2-benzamido-2-oxidanylidene-ethyl) 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate Openeye Name: (2-benzamido-2-oxo-ethyl) 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate CAS Name: 2-(3,4-dimethoxyphenyl)-4-quinolinecarboxylic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(3,4-dimethoxyphenyl)cinchoninic acid (2-benzamido-2-keto-ethyl) ester Formula: C27H22N2O6 MolecularWeight: 470.47338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)NC(=O)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)NC(=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C27H22N2O6/c1-33-23-13-12-18(14-24(23)34-2)22-15-20(19-10-6-7-11-21(19)28-22)27(32)35-16-25(30)29-26(31)17-8-4-3-5-9-17/h3-15H,16H2,1-2H3,(H,29,30,31)