6-bromanyl-2-[(4-chlorophenyl)methyl]-3-oxidanyl-quinoline-4-carboxylic acid

Systemtic Name: 6-bromanyl-2-[(4-chlorophenyl)methyl]-3-oxidanyl-quinoline-4-carboxylic acid Openeye Name: 6-bromo-2-[(4-chlorophenyl)methyl]-3-hydroxy-quinoline-4-carboxylic acid CAS Name: 6-bromo-2-[(4-chlorophenyl)methyl]-3-hydroxy-4-quinolinecarboxylic acid IUPAC Name: 6-bromo-2-[(4-chlorophenyl)methyl]-3-hydroxyquinoline-4-carboxylic acid Traditional Name: 6-bromo-2-(4-chlorobenzyl)-3-hydroxy-cinchoninic acid Formula: C17H11BrClNO3 MolecularWeight: 392.63114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=C(C(=C3C=C(C=CC3=N2)Br)C(=O)O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1CC2=C(C(=C3C=C(C=CC3=N2)Br)C(=O)O)O)Cl

InChI

InChI=1S/C17H11BrClNO3/c18-10-3-6-13-12(8-10)15(17(22)23)16(21)14(20-13)7-9-1-4-11(19)5-2-9/h1-6,8,21H,7H2,(H,22,23)