[1-oxidanylidene-1-(4-phenylmethoxyphenyl)propan-2-yl] 2-(4-chlorophenyl)-3,7,8-trimethyl-quinoline-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-(4-phenylmethoxyphenyl)propan-2-yl] 2-(4-chlorophenyl)-3,7,8-trimethyl-quinoline-4-carboxylate Openeye Name: [2-(4-benzyloxyphenyl)-1-methyl-2-oxo-ethyl] 2-(4-chlorophenyl)-3,7,8-trimethyl-quinoline-4-carboxylate CAS Name: 2-(4-chlorophenyl)-3,7,8-trimethyl-4-quinolinecarboxylic acid [1-oxo-1-(4-phenylmethoxyphenyl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenylmethoxyphenyl)propan-2-yl] 2-(4-chlorophenyl)-3,7,8-trimethylquinoline-4-carboxylate Traditional Name: 2-(4-chlorophenyl)-3,7,8-trimethyl-cinchoninic acid [2-(4-benzoxyphenyl)-2-keto-1-methyl-ethyl] ester Formula: C35H30ClNO4 MolecularWeight: 564.07

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C(=C2C=C1)C(=O)OC(C)C(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C5=CC=C(C=C5)Cl)C

Isomeric SMILES

CC1=C(C2=NC(=C(C(=C2C=C1)C(=O)OC(C)C(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C5=CC=C(C=C5)Cl)C

InChI

InChI=1S/C35H30ClNO4/c1-21-10-19-30-31(23(3)32(37-33(30)22(21)2)26-11-15-28(36)16-12-26)35(39)41-24(4)34(38)27-13-17-29(18-14-27)40-20-25-8-6-5-7-9-25/h5-19,24H,20H2,1-4H3