3-[(5-oxidanyl-5-oxidanylidene-pentanoyl)amino]benzoic acid

Systemtic Name: 3-[(5-oxidanyl-5-oxidanylidene-pentanoyl)amino]benzoic acid Openeye Name: 3-[(5-hydroxy-5-oxo-pentanoyl)amino]benzoic acid CAS Name: 3-[(5-hydroxy-1,5-dioxopentyl)amino]benzoic acid IUPAC Name: 3-[(5-hydroxy-5-oxopentanoyl)amino]benzoic acid Traditional Name: 3-[(5-hydroxy-5-keto-pentanoyl)amino]benzoic acid Formula: C12H13NO5 MolecularWeight: 251.23532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCCC(=O)O)C(=O)O

InChI

InChI=1S/C12H13NO5/c14-10(5-2-6-11(15)16)13-9-4-1-3-8(7-9)12(17)18/h1,3-4,7H,2,5-6H2,(H,13,14)(H,15,16)(H,17,18)