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

Systemtic Name: (4-bromophenyl) 3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Openeye Name: (4-bromophenyl) 2-(4-benzyloxyphenyl)-3,6,8-trimethyl-quinoline-4-carboxylate CAS Name: 3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxylic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) 3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-benzoxyphenyl)-3,6,8-trimethyl-cinchoninic acid (4-bromophenyl) ester Formula: C32H26BrNO3 MolecularWeight: 552.45774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C(=O)OC5=CC=C(C=C5)Br)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C(=O)OC5=CC=C(C=C5)Br)C

InChI

InChI=1S/C32H26BrNO3/c1-20-17-21(2)30-28(18-20)29(32(35)37-27-15-11-25(33)12-16-27)22(3)31(34-30)24-9-13-26(14-10-24)36-19-23-7-5-4-6-8-23/h4-18H,19H2,1-3H3