[2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 8-chloranyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 8-chloranyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-(4-benzyloxyphenyl)-2-oxo-ethyl] 8-chloro-2-phenyl-quinoline-4-carboxylate CAS Name: 8-chloro-2-phenyl-4-quinolinecarboxylic acid [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] 8-chloro-2-phenylquinoline-4-carboxylate Traditional Name: 8-chloro-2-phenyl-cinchoninic acid [2-(4-benzoxyphenyl)-2-keto-ethyl] ester Formula: C31H22ClNO4 MolecularWeight: 507.96368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)COC(=O)C3=CC(=NC4=C3C=CC=C4Cl)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)COC(=O)C3=CC(=NC4=C3C=CC=C4Cl)C5=CC=CC=C5

InChI

InChI=1S/C31H22ClNO4/c32-27-13-7-12-25-26(18-28(33-30(25)27)22-10-5-2-6-11-22)31(35)37-20-29(34)23-14-16-24(17-15-23)36-19-21-8-3-1-4-9-21/h1-18H,19-20H2