[2-(4-acetyloxyphenyl)-2-oxidanylidene-ethyl] 6-chloranyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-(4-acetyloxyphenyl)-2-oxidanylidene-ethyl] 6-chloranyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-(4-acetoxyphenyl)-2-oxo-ethyl] 6-chloro-2-phenyl-quinoline-4-carboxylate CAS Name: 6-chloro-2-phenyl-4-quinolinecarboxylic acid [2-(4-acetyloxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-acetyloxyphenyl)-2-oxoethyl] 6-chloro-2-phenylquinoline-4-carboxylate Traditional Name: 6-chloro-2-phenyl-cinchoninic acid [2-(4-acetoxyphenyl)-2-keto-ethyl] ester Formula: C26H18ClNO5 MolecularWeight: 459.87782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C26H18ClNO5/c1-16(29)33-20-10-7-18(8-11-20)25(30)15-32-26(31)22-14-24(17-5-3-2-4-6-17)28-23-12-9-19(27)13-21(22)23/h2-14H,15H2,1H3