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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17BrClNO2/c1-12(2)11-25-20(24)17-10-19(13-3-5-14(21)6-4-13)23-18-8-7-15(22)9-16(17)18/h3-10,12H,11H2,1-2H3