(2S)-4-azanyl-2-[(2-nitrophenyl)sulfanylazaniumyl]-4-oxidanylidene-butanoate

Systemtic Name: (2S)-4-azanyl-2-[(2-nitrophenyl)sulfanylazaniumyl]-4-oxidanylidene-butanoate Openeye Name: (2S)-4-amino-2-[(2-nitrophenyl)sulfanylammonio]-4-oxo-butanoate CAS Name: (2S)-4-amino-2-[[(2-nitrophenyl)thio]ammonio]-4-oxobutanoate IUPAC Name: (2S)-4-amino-2-[(2-nitrophenyl)sulfanylazaniumyl]-4-oxobutanoate Traditional Name: (2S)-4-amino-4-keto-2-[[(2-nitrophenyl)thio]ammonio]butyrate Formula: C10H11N3O5S MolecularWeight: 285.27644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])S[NH2+]C(CC(=O)N)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])S[NH2+][C@@H](CC(=O)N)C(=O)[O-]

InChI

InChI=1S/C10H11N3O5S/c11-9(14)5-6(10(15)16)12-19-8-4-2-1-3-7(8)13(17)18/h1-4,6,12H,5H2,(H2,11,14)(H,15,16)/t6-/m0/s1