[2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 3,6-dimethyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 3,6-dimethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-(4-benzyloxyphenyl)-2-oxo-ethyl] 3,6-dimethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 3,6-dimethyl-2-phenyl-4-quinolinecarboxylic acid [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] 3,6-dimethyl-2-phenylquinoline-4-carboxylate Traditional Name: 3,6-dimethyl-2-phenyl-cinchoninic acid [2-(4-benzoxyphenyl)-2-keto-ethyl] ester Formula: C33H27NO4 MolecularWeight: 501.57178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(N=C2C=C1)C3=CC=CC=C3)C)C(=O)OCC(=O)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C(=C(N=C2C=C1)C3=CC=CC=C3)C)C(=O)OCC(=O)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C33H27NO4/c1-22-13-18-29-28(19-22)31(23(2)32(34-29)26-11-7-4-8-12-26)33(36)38-21-30(35)25-14-16-27(17-15-25)37-20-24-9-5-3-6-10-24/h3-19H,20-21H2,1-2H3