[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-(4-ethylphenyl)quinoline-4-carboxylate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-(4-ethylphenyl)quinoline-4-carboxylate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2-(4-ethylphenyl)quinoline-4-carboxylate CAS Name: 2-(4-ethylphenyl)-4-quinolinecarboxylic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2-(4-ethylphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-ethylphenyl)cinchoninic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C26H20BrNO3 MolecularWeight: 474.3459

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C26H20BrNO3/c1-2-17-7-9-18(10-8-17)24-15-22(21-5-3-4-6-23(21)28-24)26(30)31-16-25(29)19-11-13-20(27)14-12-19/h3-15H,2,16H2,1H3