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

Systemtic Name: 2-[(6-azanyl-1-oxidanyl-1-oxidanylidene-hexan-2-yl)carbamoyl]benzoic acid Openeye Name: 2-[(5-amino-1-carboxy-pentyl)carbamoyl]benzoic acid CAS Name: 2-[[(6-amino-1-hydroxy-1-oxohexan-2-yl)amino]-oxomethyl]benzoic acid IUPAC Name: 2-[(6-amino-1-hydroxy-1-oxohexan-2-yl)carbamoyl]benzoic acid Traditional Name: 2-[(5-amino-1-carboxy-pentyl)carbamoyl]benzoic acid Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O5/c15-8-4-3-7-11(14(20)21)16-12(17)9-5-1-2-6-10(9)13(18)19/h1-2,5-6,11H,3-4,7-8,15H2,(H,16,17)(H,18,19)(H,20,21)