5-carboxy-N-oxidanyl-2-(phenylsulfanylmethyl)benzeneamine oxide

Systemtic Name: 5-carboxy-N-oxidanyl-2-(phenylsulfanylmethyl)benzeneamine oxide Openeye Name: 5-carboxy-N-hydroxy-2-(phenylsulfanylmethyl)benzeneamine oxide CAS Name: 5-carboxy-N-hydroxy-2-[(phenylthio)methyl]benzeneamine oxide IUPAC Name: 5-carboxy-N-hydroxy-2-(phenylsulfanylmethyl)benzeneamine oxide Traditional Name: 5-carboxy-N-hydroxy-2-[(phenylthio)methyl]benzeneamine oxide Formula: C14H13NO4S MolecularWeight: 291.32232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC2=C(C=C(C=C2)C(=O)O)[NH+](O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SCC2=C(C=C(C=C2)C(=O)O)[NH+](O)[O-]

InChI

InChI=1S/C14H13NO4S/c16-14(17)10-6-7-11(13(8-10)15(18)19)9-20-12-4-2-1-3-5-12/h1-8,15,18H,9H2,(H,16,17)