[2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 6-chloranyl-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 6-chloranyl-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxylate Openeye Name: [2-(4-benzyloxyphenyl)-2-oxo-ethyl] 6-chloro-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxylate CAS Name: 6-chloro-2-(4-methoxyphenyl)-3-methyl-4-quinolinecarboxylic acid [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] 6-chloro-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxylate Traditional Name: 6-chloro-2-(4-methoxyphenyl)-3-methyl-cinchoninic acid [2-(4-benzoxyphenyl)-2-keto-ethyl] ester Formula: C33H26ClNO5 MolecularWeight: 552.01624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC(=CC2=C1C(=O)OCC(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)Cl)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=C(N=C2C=CC(=CC2=C1C(=O)OCC(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)Cl)C5=CC=C(C=C5)OC

InChI

InChI=1S/C33H26ClNO5/c1-21-31(28-18-25(34)12-17-29(28)35-32(21)24-10-13-26(38-2)14-11-24)33(37)40-20-30(36)23-8-15-27(16-9-23)39-19-22-6-4-3-5-7-22/h3-18H,19-20H2,1-2H3