(2S)-2-azaniumyl-4-[methyl-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfonio]butanoate

Systemtic Name: (2S)-2-azaniumyl-4-[methyl-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfonio]butanoate Openeye Name: (2S)-2-azaniumyl-4-[methyl-(2-oxido-2-oxo-ethyl)sulfonio]butanoate CAS Name: (2S)-2-ammonio-4-[methyl-(2-oxido-2-oxoethyl)sulfonio]butanoate IUPAC Name: (2S)-2-azaniumyl-4-[methyl-(2-oxido-2-oxoethyl)sulfonio]butanoate Traditional Name: (2S)-2-ammonio-4-[(2-keto-2-oxido-ethyl)-methyl-sulfonio]butyrate Formula: C7H13NO4S MolecularWeight: 207.24742

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Descriptors Computed from Structure

Canonical SMILES:

C[S+](CCC(C(=O)[O-])[NH3+])CC(=O)[O-]

Isomeric SMILES

C[S+](CC[C@@H](C(=O)[O-])[NH3+])CC(=O)[O-]

InChI

InChI=1S/C7H13NO4S/c1-13(4-6(9)10)3-2-5(8)7(11)12/h5H,2-4,8H2,1H3,(H-,9,10,11,12)/t5-,13?/m0/s1