4-azanyl-3-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]benzoic acid

Systemtic Name: 4-azanyl-3-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]benzoic acid Openeye Name: 4-amino-3-[(2-hydroxy-1-methyl-2-oxo-ethyl)amino]benzoic acid CAS Name: 4-amino-3-[(1-hydroxy-1-oxopropan-2-yl)amino]benzoic acid IUPAC Name: 4-amino-3-[(1-hydroxy-1-oxopropan-2-yl)amino]benzoic acid Traditional Name: 4-amino-3-[(2-hydroxy-2-keto-1-methyl-ethyl)amino]benzoic acid Formula: C10H12N2O4 MolecularWeight: 224.21328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC1=C(C=CC(=C1)C(=O)O)N

Isomeric SMILES

CC(C(=O)O)NC1=C(C=CC(=C1)C(=O)O)N

InChI

InChI=1S/C10H12N2O4/c1-5(9(13)14)12-8-4-6(10(15)16)2-3-7(8)11/h2-5,12H,11H2,1H3,(H,13,14)(H,15,16)