6-chloranylquinoline-3,4,5-tricarboxylic acid

Systemtic Name: 6-chloranylquinoline-3,4,5-tricarboxylic acid Openeye Name: 6-chloroquinoline-3,4,5-tricarboxylic acid CAS Name: 6-chloroquinoline-3,4,5-tricarboxylic acid IUPAC Name: 6-chloroquinoline-3,4,5-tricarboxylic acid Traditional Name: 6-chloroquinoline-3,4,5-tricarboxylic acid Formula: C12H6ClNO6 MolecularWeight: 295.63214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC=C(C(=C2C(=C1Cl)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC2=NC=C(C(=C2C(=C1Cl)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C12H6ClNO6/c13-5-1-2-6-9(8(5)12(19)20)7(11(17)18)4(3-14-6)10(15)16/h1-3H,(H,15,16)(H,17,18)(H,19,20)