[(2R)-1-oxidanylidene-1-phenyl-butan-2-yl] 2-(4-bromophenyl)-8-methyl-quinoline-4-carboxylate

Systemtic Name: [(2R)-1-oxidanylidene-1-phenyl-butan-2-yl] 2-(4-bromophenyl)-8-methyl-quinoline-4-carboxylate Openeye Name: [(1R)-1-benzoylpropyl] 2-(4-bromophenyl)-8-methyl-quinoline-4-carboxylate CAS Name: 2-(4-bromophenyl)-8-methyl-4-quinolinecarboxylic acid [(2R)-1-oxo-1-phenylbutan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-phenylbutan-2-yl] 2-(4-bromophenyl)-8-methylquinoline-4-carboxylate Traditional Name: 2-(4-bromophenyl)-8-methyl-cinchoninic acid [(1R)-1-benzoylpropyl] ester Formula: C27H22BrNO3 MolecularWeight: 488.37248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC(=NC3=C2C=CC=C3C)C4=CC=C(C=C4)Br

Isomeric SMILES

CC[C@H](C(=O)C1=CC=CC=C1)OC(=O)C2=CC(=NC3=C2C=CC=C3C)C4=CC=C(C=C4)Br

InChI

InChI=1S/C27H22BrNO3/c1-3-24(26(30)19-9-5-4-6-10-19)32-27(31)22-16-23(18-12-14-20(28)15-13-18)29-25-17(2)8-7-11-21(22)25/h4-16,24H,3H2,1-2H3/t24-/m1/s1