[2-oxidanylidene-2-[4-(phenylcarbonyloxy)phenyl]ethyl] 2-methylquinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[4-(phenylcarbonyloxy)phenyl]ethyl] 2-methylquinoline-4-carboxylate Openeye Name: [2-(4-benzoyloxyphenyl)-2-oxo-ethyl] 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid [2-(4-benzoyloxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-benzoyloxyphenyl)-2-oxoethyl] 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid [2-(4-benzoyloxyphenyl)-2-keto-ethyl] ester Formula: C26H19NO5 MolecularWeight: 425.43276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H19NO5/c1-17-15-22(21-9-5-6-10-23(21)27-17)26(30)31-16-24(28)18-11-13-20(14-12-18)32-25(29)19-7-3-2-4-8-19/h2-15H,16H2,1H3