orthanilate

Chemical Formula:

C₆H₆NO₃S

Molecular Weight:

172.178 Daltons

Monoisotopic Mass:

173.0146637862 Daltons

SMILES:

C1(C=CC(=C(C=1)N)S([O-])(=O)=O)

InChI:

1S/C6H7NO3S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,7H2,(H,8,9,10)/p-1

InChIKey:

ZMCHBSMFKQYNKA-UHFFFAOYSA-M

Synonyms

Databases

MetaCyc: 2-AMINOBENZENESULFONATE

RefMet: 2-aminobenzenesulfoni 2-aminobenzenesulfonic acid

ChemSpider: 4573818

PubChem (CID): 5460186

ChEBI: 15942

KEGG: C06333

NCI: 147

Seed: cpd03774

MetaNetX: MNXM3806