[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-(4-methoxyphenyl)-6,8-dimethyl-quinoline-4-carboxylate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-(4-methoxyphenyl)-6,8-dimethyl-quinoline-4-carboxylate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2-(4-methoxyphenyl)-6,8-dimethyl-quinoline-4-carboxylate CAS Name: 2-(4-methoxyphenyl)-6,8-dimethyl-4-quinolinecarboxylic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2-(4-methoxyphenyl)-6,8-dimethylquinoline-4-carboxylate Traditional Name: 2-(4-methoxyphenyl)-6,8-dimethyl-cinchoninic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C27H22BrNO4 MolecularWeight: 504.37188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)OC)C(=O)OCC(=O)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)OC)C(=O)OCC(=O)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C27H22BrNO4/c1-16-12-17(2)26-22(13-16)23(14-24(29-26)18-6-10-21(32-3)11-7-18)27(31)33-15-25(30)19-4-8-20(28)9-5-19/h4-14H,15H2,1-3H3