6-azanyl-2-[[2,3-bis(oxidanyl)phenyl]carbonylamino]hexanoic acid

Systemtic Name: 6-azanyl-2-[[2,3-bis(oxidanyl)phenyl]carbonylamino]hexanoic acid Openeye Name: 6-amino-2-[(2,3-dihydroxybenzoyl)amino]hexanoic acid CAS Name: 6-amino-2-[[(2,3-dihydroxyphenyl)-oxomethyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[(2,3-dihydroxybenzoyl)amino]hexanoic acid Traditional Name: 6-amino-2-[(2,3-dihydroxybenzoyl)amino]hexanoic acid Formula: C13H18N2O5 MolecularWeight: 282.29242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O5/c14-7-2-1-5-9(13(19)20)15-12(18)8-4-3-6-10(16)11(8)17/h3-4,6,9,16-17H,1-2,5,7,14H2,(H,15,18)(H,19,20)