2-oxidanyl-2-(quinolin-3-ylmethyl)propanedioic acid

Systemtic Name: 2-oxidanyl-2-(quinolin-3-ylmethyl)propanedioic acid Openeye Name: 2-hydroxy-2-(3-quinolylmethyl)propanedioic acid CAS Name: 2-hydroxy-2-(3-quinolinylmethyl)propanedioic acid IUPAC Name: 2-hydroxy-2-(quinolin-3-ylmethyl)propanedioic acid Traditional Name: 2-hydroxy-2-(3-quinolylmethyl)malonic acid Formula: C13H11NO5 MolecularWeight: 261.23014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11NO5/c15-11(16)13(19,12(17)18)6-8-5-9-3-1-2-4-10(9)14-7-8/h1-5,7,19H,6H2,(H,15,16)(H,17,18)