1-(carboxymethyl)-9-oxidanyl-4,6-bis(oxidanylidene)cyclohepta[b]pyridine-3-carboxylic acid

Systemtic Name: 1-(carboxymethyl)-9-oxidanyl-4,6-bis(oxidanylidene)cyclohepta[b]pyridine-3-carboxylic acid Openeye Name: 1-(carboxymethyl)-9-hydroxy-4,6-dioxo-cyclohepta[b]pyridine-3-carboxylic acid CAS Name: 1-(carboxymethyl)-9-hydroxy-4,6-dioxo-3-cyclohepta[b]pyridinecarboxylic acid IUPAC Name: 1-(carboxymethyl)-9-hydroxy-4,6-dioxocyclohepta[b]pyridine-3-carboxylic acid Traditional Name: 1-(carboxymethyl)-9-hydroxy-4,6-diketo-cyclohepta[b]pyridine-3-carboxylic acid Formula: C13H9NO7 MolecularWeight: 291.21306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=CC1=O)C(=O)C(=CN2CC(=O)O)C(=O)O)O

Isomeric SMILES

C1=CC(=C2C(=CC1=O)C(=O)C(=CN2CC(=O)O)C(=O)O)O

InChI

InChI=1S/C13H9NO7/c15-6-1-2-9(16)11-7(3-6)12(19)8(13(20)21)4-14(11)5-10(17)18/h1-4,16H,5H2,(H,17,18)(H,20,21)