[2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] 2-(2,4-dimethylphenyl)quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] 2-(2,4-dimethylphenyl)quinoline-4-carboxylate Openeye Name: [2-(2-benzoylhydrazino)-2-oxo-ethyl] 2-(2,4-dimethylphenyl)quinoline-4-carboxylate CAS Name: 2-(2,4-dimethylphenyl)-4-quinolinecarboxylic acid [2-(benzoylhydrazo)-2-oxoethyl] ester IUPAC Name: [2-(2-benzoylhydrazinyl)-2-oxoethyl] 2-(2,4-dimethylphenyl)quinoline-4-carboxylate Traditional Name: 2-(2,4-dimethylphenyl)cinchoninic acid [2-(N'-benzoylhydrazino)-2-keto-ethyl] ester Formula: C27H23N3O4 MolecularWeight: 453.48922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)NNC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)NNC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C27H23N3O4/c1-17-12-13-20(18(2)14-17)24-15-22(21-10-6-7-11-23(21)28-24)27(33)34-16-25(31)29-30-26(32)19-8-4-3-5-9-19/h3-15H,16H2,1-2H3,(H,29,31)(H,30,32)