(2S)-2-[(4-azanyl-2-oxidanyl-phenyl)carbonylamino]pentanedioic acid

Systemtic Name: (2S)-2-[(4-azanyl-2-oxidanyl-phenyl)carbonylamino]pentanedioic acid Openeye Name: (2S)-2-[(4-amino-2-hydroxy-benzoyl)amino]pentanedioic acid CAS Name: (2S)-2-[[(4-amino-2-hydroxyphenyl)-oxomethyl]amino]pentanedioic acid IUPAC Name: (2S)-2-[(4-amino-2-hydroxybenzoyl)amino]pentanedioic acid Traditional Name: (2S)-2-[(4-amino-2-hydroxy-benzoyl)amino]glutaric acid Formula: C12H14N2O6 MolecularWeight: 282.24936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)O)C(=O)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1N)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O

InChI

InChI=1S/C12H14N2O6/c13-6-1-2-7(9(15)5-6)11(18)14-8(12(19)20)3-4-10(16)17/h1-2,5,8,15H,3-4,13H2,(H,14,18)(H,16,17)(H,19,20)/t8-/m0/s1