6-bromanyl-3-ethanoyl-quinoline-4-carboxylic acid

Systemtic Name: 6-bromanyl-3-ethanoyl-quinoline-4-carboxylic acid Openeye Name: 3-acetyl-6-bromo-quinoline-4-carboxylic acid CAS Name: 3-acetyl-6-bromo-4-quinolinecarboxylic acid IUPAC Name: 3-acetyl-6-bromoquinoline-4-carboxylic acid Traditional Name: 3-acetyl-6-bromo-cinchoninic acid Formula: C12H8BrNO3 MolecularWeight: 294.10082

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN=C2C=CC(=CC2=C1C(=O)O)Br

Isomeric SMILES

CC(=O)C1=CN=C2C=CC(=CC2=C1C(=O)O)Br

InChI

InChI=1S/C12H8BrNO3/c1-6(15)9-5-14-10-3-2-7(13)4-8(10)11(9)12(16)17/h2-5H,1H3,(H,16,17)