3-(carboxymethyl)quinoline-2,4-dicarboxylic acid

Systemtic Name: 3-(carboxymethyl)quinoline-2,4-dicarboxylic acid Openeye Name: 3-(carboxymethyl)quinoline-2,4-dicarboxylic acid CAS Name: 3-(carboxymethyl)quinoline-2,4-dicarboxylic acid IUPAC Name: 3-(carboxymethyl)quinoline-2,4-dicarboxylic acid Traditional Name: 3-(carboxymethyl)quinoline-2,4-dicarboxylic acid Formula: C13H9NO6 MolecularWeight: 275.21366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C(=N2)C(=O)O)CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C(=N2)C(=O)O)CC(=O)O)C(=O)O

InChI

InChI=1S/C13H9NO6/c15-9(16)5-7-10(12(17)18)6-3-1-2-4-8(6)14-11(7)13(19)20/h1-4H,5H2,(H,15,16)(H,17,18)(H,19,20)