[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 2-(4-bromophenyl)-7,8-dimethyl-quinoline-4-carboxylate

Systemtic Name: [2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 2-(4-bromophenyl)-7,8-dimethyl-quinoline-4-carboxylate Openeye Name: [2-(3-methoxyphenyl)-2-oxo-ethyl] 2-(4-bromophenyl)-7,8-dimethyl-quinoline-4-carboxylate CAS Name: 2-(4-bromophenyl)-7,8-dimethyl-4-quinolinecarboxylic acid [2-(3-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-methoxyphenyl)-2-oxoethyl] 2-(4-bromophenyl)-7,8-dimethylquinoline-4-carboxylate Traditional Name: 2-(4-bromophenyl)-7,8-dimethyl-cinchoninic acid [2-keto-2-(3-methoxyphenyl)ethyl] ester Formula: C27H22BrNO4 MolecularWeight: 504.37188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=N2)C3=CC=C(C=C3)Br)C(=O)OCC(=O)C4=CC(=CC=C4)OC)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=N2)C3=CC=C(C=C3)Br)C(=O)OCC(=O)C4=CC(=CC=C4)OC)C

InChI

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