3-[2-carboxy-5-(oxidanylamino)-5-oxidanylidene-pentyl]benzoic acid

Systemtic Name: 3-[2-carboxy-5-(oxidanylamino)-5-oxidanylidene-pentyl]benzoic acid Openeye Name: 3-[2-carboxy-5-(hydroxyamino)-5-oxo-pentyl]benzoic acid CAS Name: 3-[2-carboxy-5-(hydroxyamino)-5-oxopentyl]benzoic acid IUPAC Name: 3-[2-carboxy-5-(hydroxyamino)-5-oxopentyl]benzoic acid Traditional Name: 3-[2-carboxy-5-(hydroxyamino)-5-keto-pentyl]benzoic acid Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CC(CCC(=O)NO)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)CC(CCC(=O)NO)C(=O)O)C(=O)O

InChI

InChI=1S/C13H15NO6/c15-11(14-20)5-4-10(13(18)19)7-8-2-1-3-9(6-8)12(16)17/h1-3,6,10,20H,4-5,7H2,(H,14,15)(H,16,17)(H,18,19)