2-[1-[(2S)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]sulfanylcarbonyloxy-2-oxidanyl-2-oxidanylidene-ethyl]-N-oxidanyl-benzeneamine oxide

Systemtic Name: 2-[1-[(2S)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]sulfanylcarbonyloxy-2-oxidanyl-2-oxidanylidene-ethyl]-N-oxidanyl-benzeneamine oxide Openeye Name: 2-[1-[(2S)-2-amino-3-hydroxy-3-oxo-propyl]sulfanylcarbonyloxy-2-hydroxy-2-oxo-ethyl]-N-hydroxy-benzeneamine oxide CAS Name: 2-[1-[[[(2S)-2-amino-3-hydroxy-3-oxopropyl]thio]-oxomethoxy]-2-hydroxy-2-oxoethyl]-N-hydroxybenzeneamine oxide IUPAC Name: 2-[1-[(2S)-2-amino-3-hydroxy-3-oxopropyl]sulfanylcarbonyloxy-2-hydroxy-2-oxoethyl]-N-hydroxybenzeneamine oxide Traditional Name: 2-[1-[[(2S)-2-amino-3-hydroxy-3-keto-propyl]thio]carbonyloxy-2-hydroxy-2-keto-ethyl]-N-hydroxy-benzeneamine oxide Formula: C12H14N2O8S MolecularWeight: 346.31316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(C(=O)O)OC(=O)SCC(C(=O)O)N)[NH+](O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(C(=O)O)OC(=O)SC[C@H](C(=O)O)N)[NH+](O)[O-]

InChI

InChI=1S/C12H14N2O8S/c13-7(10(15)16)5-23-12(19)22-9(11(17)18)6-3-1-2-4-8(6)14(20)21/h1-4,7,9,14,20H,5,13H2,(H,15,16)(H,17,18)/t7-,9?/m1/s1