2-(2-azanylethyl)-N-oxidanyl-5-sulfo-benzeneamine oxide

Systemtic Name: 2-(2-azanylethyl)-N-oxidanyl-5-sulfo-benzeneamine oxide Openeye Name: 2-(2-aminoethyl)-N-hydroxy-5-sulfo-benzeneamine oxide CAS Name: 2-(2-aminoethyl)-N-hydroxy-5-sulfobenzeneamine oxide IUPAC Name: 2-(2-aminoethyl)-N-hydroxy-5-sulfobenzeneamine oxide Traditional Name: 2-(2-aminoethyl)-N-hydroxy-5-sulfo-benzeneamine oxide Formula: C8H12N2O5S MolecularWeight: 248.25628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)O)[NH+](O)[O-])CCN

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)O)[NH+](O)[O-])CCN

InChI

InChI=1S/C8H12N2O5S/c9-4-3-6-1-2-7(16(13,14)15)5-8(6)10(11)12/h1-2,5,10-11H,3-4,9H2,(H,13,14,15)