(4-tert-butylphenyl) 2-(4-bromophenyl)quinoline-4-carboxylate

Systemtic Name: (4-tert-butylphenyl) 2-(4-bromophenyl)quinoline-4-carboxylate Openeye Name: (4-tert-butylphenyl) 2-(4-bromophenyl)quinoline-4-carboxylate CAS Name: 2-(4-bromophenyl)-4-quinolinecarboxylic acid (4-tert-butylphenyl) ester IUPAC Name: (4-tert-butylphenyl) 2-(4-bromophenyl)quinoline-4-carboxylate Traditional Name: 2-(4-bromophenyl)cinchoninic acid (4-tert-butylphenyl) ester Formula: C26H22BrNO2 MolecularWeight: 460.36238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br

InChI

InChI=1S/C26H22BrNO2/c1-26(2,3)18-10-14-20(15-11-18)30-25(29)22-16-24(17-8-12-19(27)13-9-17)28-23-7-5-4-6-21(22)23/h4-16H,1-3H3