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

Systemtic Name: [2-(4-chlorophenyl)-2-oxidanylidene-ethyl] 6-ethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-(4-chlorophenyl)-2-oxo-ethyl] 6-ethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 6-ethyl-2-phenyl-4-quinolinecarboxylic acid [2-(4-chlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-chlorophenyl)-2-oxoethyl] 6-ethyl-2-phenylquinoline-4-carboxylate Traditional Name: 6-ethyl-2-phenyl-cinchoninic acid [2-(4-chlorophenyl)-2-keto-ethyl] ester Formula: C26H20ClNO3 MolecularWeight: 429.8949

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C26H20ClNO3/c1-2-17-8-13-23-21(14-17)22(15-24(28-23)18-6-4-3-5-7-18)26(30)31-16-25(29)19-9-11-20(27)12-10-19/h3-15H,2,16H2,1H3