[2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 7-chloranyl-3,8-dimethyl-2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 7-chloranyl-3,8-dimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: [2-(4-benzyloxyphenyl)-2-oxo-ethyl] 7-chloro-3,8-dimethyl-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 7-chloro-3,8-dimethyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] 7-chloro-3,8-dimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 7-chloro-3,8-dimethyl-2-(p-tolyl)cinchoninic acid [2-(4-benzoxyphenyl)-2-keto-ethyl] ester Formula: C34H28ClNO4 MolecularWeight: 550.04342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=C3C=CC(=C(C3=N2)C)Cl)C(=O)OCC(=O)C4=CC=C(C=C4)OCC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=C3C=CC(=C(C3=N2)C)Cl)C(=O)OCC(=O)C4=CC=C(C=C4)OCC5=CC=CC=C5)C

InChI

InChI=1S/C34H28ClNO4/c1-21-9-11-26(12-10-21)32-23(3)31(28-17-18-29(35)22(2)33(28)36-32)34(38)40-20-30(37)25-13-15-27(16-14-25)39-19-24-7-5-4-6-8-24/h4-18H,19-20H2,1-3H3