butyl 2-(4-bromophenyl)-6-chloranyl-quinoline-4-carboxylate

Systemtic Name: butyl 2-(4-bromophenyl)-6-chloranyl-quinoline-4-carboxylate Openeye Name: butyl 2-(4-bromophenyl)-6-chloro-quinoline-4-carboxylate CAS Name: 2-(4-bromophenyl)-6-chloro-4-quinolinecarboxylic acid butyl ester IUPAC Name: butyl 2-(4-bromophenyl)-6-chloroquinoline-4-carboxylate Traditional Name: 2-(4-bromophenyl)-6-chloro-cinchoninic acid butyl ester Formula: C20H17BrClNO2 MolecularWeight: 418.71148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=NC2=C1C=C(C=C2)Cl)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCOC(=O)C1=CC(=NC2=C1C=C(C=C2)Cl)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H17BrClNO2/c1-2-3-10-25-20(24)17-12-19(13-4-6-14(21)7-5-13)23-18-9-8-15(22)11-16(17)18/h4-9,11-12H,2-3,10H2,1H3