naphthalen-2-yl 2-(4-bromophenyl)quinoline-4-carboxylate

Systemtic Name: naphthalen-2-yl 2-(4-bromophenyl)quinoline-4-carboxylate Openeye Name: 2-naphthyl 2-(4-bromophenyl)quinoline-4-carboxylate CAS Name: 2-(4-bromophenyl)-4-quinolinecarboxylic acid 2-naphthalenyl ester IUPAC Name: naphthalen-2-yl 2-(4-bromophenyl)quinoline-4-carboxylate Traditional Name: 2-(4-bromophenyl)cinchoninic acid 2-naphthyl ester Formula: C26H16BrNO2 MolecularWeight: 454.31474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)OC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)Br

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)OC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)Br

InChI

InChI=1S/C26H16BrNO2/c27-20-12-9-18(10-13-20)25-16-23(22-7-3-4-8-24(22)28-25)26(29)30-21-14-11-17-5-1-2-6-19(17)15-21/h1-16H