[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 7-chloranyl-8-methyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 7-chloranyl-8-methyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 7-chloro-8-methyl-2-phenyl-quinoline-4-carboxylate CAS Name: 7-chloro-8-methyl-2-phenyl-4-quinolinecarboxylic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 7-chloro-8-methyl-2-phenylquinoline-4-carboxylate Traditional Name: 7-chloro-8-methyl-2-phenyl-cinchoninic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C25H17BrClNO3 MolecularWeight: 494.76438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)Cl

InChI

InChI=1S/C25H17BrClNO3/c1-15-21(27)12-11-19-20(13-22(28-24(15)19)16-5-3-2-4-6-16)25(30)31-14-23(29)17-7-9-18(26)10-8-17/h2-13H,14H2,1H3