heptyl 2-(4-bromophenyl)quinoline-4-carboxylate

Systemtic Name: heptyl 2-(4-bromophenyl)quinoline-4-carboxylate Openeye Name: heptyl 2-(4-bromophenyl)quinoline-4-carboxylate CAS Name: 2-(4-bromophenyl)-4-quinolinecarboxylic acid heptyl ester IUPAC Name: heptyl 2-(4-bromophenyl)quinoline-4-carboxylate Traditional Name: 2-(4-bromophenyl)cinchoninic acid heptyl ester Formula: C23H24BrNO2 MolecularWeight: 426.34616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCCCCOC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Br

InChI

InChI=1S/C23H24BrNO2/c1-2-3-4-5-8-15-27-23(26)20-16-22(17-11-13-18(24)14-12-17)25-21-10-7-6-9-19(20)21/h6-7,9-14,16H,2-5,8,15H2,1H3