hexyl 2-(4-bromophenyl)-8-methyl-quinoline-4-carboxylate

Systemtic Name: hexyl 2-(4-bromophenyl)-8-methyl-quinoline-4-carboxylate Openeye Name: hexyl 2-(4-bromophenyl)-8-methyl-quinoline-4-carboxylate CAS Name: 2-(4-bromophenyl)-8-methyl-4-quinolinecarboxylic acid hexyl ester IUPAC Name: hexyl 2-(4-bromophenyl)-8-methylquinoline-4-carboxylate Traditional Name: 2-(4-bromophenyl)-8-methyl-cinchoninic acid hexyl ester Formula: C23H24BrNO2 MolecularWeight: 426.34616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC(=NC2=C1C=CC=C2C)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCCCOC(=O)C1=CC(=NC2=C1C=CC=C2C)C3=CC=C(C=C3)Br

InChI

InChI=1S/C23H24BrNO2/c1-3-4-5-6-14-27-23(26)20-15-21(17-10-12-18(24)13-11-17)25-22-16(2)8-7-9-19(20)22/h7-13,15H,3-6,14H2,1-2H3