(4-bromophenyl) 2-(4-methoxyphenyl)-3,6,8-trimethyl-quinoline-4-carboxylate

Systemtic Name: (4-bromophenyl) 2-(4-methoxyphenyl)-3,6,8-trimethyl-quinoline-4-carboxylate Openeye Name: (4-bromophenyl) 2-(4-methoxyphenyl)-3,6,8-trimethyl-quinoline-4-carboxylate CAS Name: 2-(4-methoxyphenyl)-3,6,8-trimethyl-4-quinolinecarboxylic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) 2-(4-methoxyphenyl)-3,6,8-trimethylquinoline-4-carboxylate Traditional Name: 2-(4-methoxyphenyl)-3,6,8-trimethyl-cinchoninic acid (4-bromophenyl) ester Formula: C26H22BrNO3 MolecularWeight: 476.36178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)OC)C)C(=O)OC4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)OC)C)C(=O)OC4=CC=C(C=C4)Br)C

InChI

InChI=1S/C26H22BrNO3/c1-15-13-16(2)24-22(14-15)23(26(29)31-21-11-7-19(27)8-12-21)17(3)25(28-24)18-5-9-20(30-4)10-6-18/h5-14H,1-4H3