2-[[(6-azanyl-1-oxidanyl-1-oxidanylidene-hexan-2-yl)amino]oxymethyl]benzoic acid

Systemtic Name: 2-[[(6-azanyl-1-oxidanyl-1-oxidanylidene-hexan-2-yl)amino]oxymethyl]benzoic acid Openeye Name: 2-[[(5-amino-1-carboxy-pentyl)amino]oxymethyl]benzoic acid CAS Name: 2-[[(6-amino-1-hydroxy-1-oxohexan-2-yl)amino]oxymethyl]benzoic acid IUPAC Name: 2-[[(6-amino-1-hydroxy-1-oxohexan-2-yl)amino]oxymethyl]benzoic acid Traditional Name: 2-[[(5-amino-1-carboxy-pentyl)amino]oxymethyl]benzoic acid Formula: C14H20N2O5 MolecularWeight: 296.319

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CONC(CCCCN)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CONC(CCCCN)C(=O)O)C(=O)O

InChI

InChI=1S/C14H20N2O5/c15-8-4-3-7-12(14(19)20)16-21-9-10-5-1-2-6-11(10)13(17)18/h1-2,5-6,12,16H,3-4,7-9,15H2,(H,17,18)(H,19,20)