2-[(3-azaniumyl-4-oxidanidyl-4-oxidanylidene-butyl)sulfonylmethyl]butanoate

Systemtic Name: 2-[(3-azaniumyl-4-oxidanidyl-4-oxidanylidene-butyl)sulfonylmethyl]butanoate Openeye Name: 2-[(3-azaniumyl-4-oxido-4-oxo-butyl)sulfonylmethyl]butanoate CAS Name: 2-[(3-ammonio-4-oxido-4-oxobutyl)sulfonylmethyl]butanoate IUPAC Name: 2-[(3-azaniumyl-4-oxido-4-oxobutyl)sulfonylmethyl]butanoate Traditional Name: 2-[(3-ammonio-4-keto-4-oxido-butyl)sulfonylmethyl]butyrate Formula: C9H16NO6S- MolecularWeight: 266.29144

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CS(=O)(=O)CCC(C(=O)[O-])[NH3+])C(=O)[O-]

Isomeric SMILES

CCC(CS(=O)(=O)CCC(C(=O)[O-])[NH3+])C(=O)[O-]

InChI

InChI=1S/C9H17NO6S/c1-2-6(8(11)12)5-17(15,16)4-3-7(10)9(13)14/h6-7H,2-5,10H2,1H3,(H,11,12)(H,13,14)/p-1