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

Systemtic Name: 3-tert-butyl-5-[2-carboxy-5-(oxidanylamino)-5-oxidanylidene-pentyl]benzoic acid Openeye Name: 3-tert-butyl-5-[2-carboxy-5-(hydroxyamino)-5-oxo-pentyl]benzoic acid CAS Name: 3-tert-butyl-5-[2-carboxy-5-(hydroxyamino)-5-oxopentyl]benzoic acid IUPAC Name: 3-tert-butyl-5-[2-carboxy-5-(hydroxyamino)-5-oxopentyl]benzoic acid Traditional Name: 3-tert-butyl-5-[2-carboxy-5-(hydroxyamino)-5-keto-pentyl]benzoic acid Formula: C17H23NO6 MolecularWeight: 337.36762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23NO6/c1-17(2,3)13-8-10(7-12(9-13)16(22)23)6-11(15(20)21)4-5-14(19)18-24/h7-9,11,24H,4-6H2,1-3H3,(H,18,19)(H,20,21)(H,22,23)