4-(1-azanyl-2-oxidanyl-2-oxidanylidene-ethyl)sulfonylbenzoic acid

Systemtic Name: 4-(1-azanyl-2-oxidanyl-2-oxidanylidene-ethyl)sulfonylbenzoic acid Openeye Name: 4-(1-amino-2-hydroxy-2-oxo-ethyl)sulfonylbenzoic acid CAS Name: 4-(1-amino-2-hydroxy-2-oxoethyl)sulfonylbenzoic acid IUPAC Name: 4-(1-amino-2-hydroxy-2-oxoethyl)sulfonylbenzoic acid Traditional Name: 4-(1-amino-2-hydroxy-2-keto-ethyl)sulfonylbenzoic acid Formula: C9H9NO6S MolecularWeight: 259.23586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)S(=O)(=O)C(C(=O)O)N

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)S(=O)(=O)C(C(=O)O)N

InChI

InChI=1S/C9H9NO6S/c10-7(9(13)14)17(15,16)6-3-1-5(2-4-6)8(11)12/h1-4,7H,10H2,(H,11,12)(H,13,14)