3-(2-carboxyethylsulfanylcarbonylamino)-N-oxidanyl-benzeneamine oxide

Systemtic Name: 3-(2-carboxyethylsulfanylcarbonylamino)-N-oxidanyl-benzeneamine oxide Openeye Name: 3-(2-carboxyethylsulfanylcarbonylamino)-N-hydroxy-benzeneamine oxide CAS Name: 3-[[(2-carboxyethylthio)-oxomethyl]amino]-N-hydroxybenzeneamine oxide IUPAC Name: 3-(2-carboxyethylsulfanylcarbonylamino)-N-hydroxybenzeneamine oxide Traditional Name: 3-[(2-carboxyethylthio)carbonylamino]-N-hydroxy-benzeneamine oxide Formula: C10H12N2O5S MolecularWeight: 272.27768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[NH+](O)[O-])NC(=O)SCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[NH+](O)[O-])NC(=O)SCCC(=O)O

InChI

InChI=1S/C10H12N2O5S/c13-9(14)4-5-18-10(15)11-7-2-1-3-8(6-7)12(16)17/h1-3,6,12,16H,4-5H2,(H,11,15)(H,13,14)