1-(carboxymethyl)-4,9-bis(oxidanylidene)cyclohepta[b]pyridine-3-carboxylic acid

Systemtic Name: 1-(carboxymethyl)-4,9-bis(oxidanylidene)cyclohepta[b]pyridine-3-carboxylic acid Openeye Name: 1-(carboxymethyl)-4,9-dioxo-cyclohepta[b]pyridine-3-carboxylic acid CAS Name: 1-(carboxymethyl)-4,9-dioxo-3-cyclohepta[b]pyridinecarboxylic acid IUPAC Name: 1-(carboxymethyl)-4,9-dioxocyclohepta[b]pyridine-3-carboxylic acid Traditional Name: 1-(carboxymethyl)-4,9-diketo-cyclohepta[b]pyridine-3-carboxylic acid Formula: C13H9NO6 MolecularWeight: 275.21366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=O)C=C1)N(C=C(C2=O)C(=O)O)CC(=O)O

Isomeric SMILES

C1=CC2=C(C(=O)C=C1)N(C=C(C2=O)C(=O)O)CC(=O)O

InChI

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