(4-bromophenyl)methyl 2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxylate

Systemtic Name: (4-bromophenyl)methyl 2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxylate Openeye Name: (4-bromophenyl)methyl 2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxylate CAS Name: 2-(3,4,5-trimethoxyphenyl)-4-quinolinecarboxylic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(3,4,5-trimethoxyphenyl)cinchoninic acid (4-bromobenzyl) ester Formula: C26H22BrNO5 MolecularWeight: 508.36058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=CC=C(C=C4)Br

InChI

InChI=1S/C26H22BrNO5/c1-30-23-12-17(13-24(31-2)25(23)32-3)22-14-20(19-6-4-5-7-21(19)28-22)26(29)33-15-16-8-10-18(27)11-9-16/h4-14H,15H2,1-3H3