[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 7-chloranyl-8-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate

Systemtic Name: [2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 7-chloranyl-8-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Openeye Name: [2-(3-methoxyphenyl)-2-oxo-ethyl] 2-(4-benzyloxyphenyl)-7-chloro-8-methyl-quinoline-4-carboxylate CAS Name: 7-chloro-8-methyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxylic acid [2-(3-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-methoxyphenyl)-2-oxoethyl] 7-chloro-8-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-benzoxyphenyl)-7-chloro-8-methyl-cinchoninic acid [2-keto-2-(3-methoxyphenyl)ethyl] ester Formula: C33H26ClNO5 MolecularWeight: 552.01624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC(=CC=C3)OC)C4=CC=C(C=C4)OCC5=CC=CC=C5)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC(=CC=C3)OC)C4=CC=C(C=C4)OCC5=CC=CC=C5)Cl

InChI

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