(1R,2S,3S)-3-azaniumyl-2-methyl-4-oxidanylidene-cyclobutane-1-sulfonate

Systemtic Name: (1R,2S,3S)-3-azaniumyl-2-methyl-4-oxidanylidene-cyclobutane-1-sulfonate Openeye Name: (1R,2S,3S)-3-azaniumyl-2-methyl-4-oxo-cyclobutanesulfonate CAS Name: (1R,2S,3S)-3-ammonio-2-methyl-4-oxo-1-cyclobutanesulfonate IUPAC Name: (1R,2S,3S)-3-azaniumyl-2-methyl-4-oxocyclobutane-1-sulfonate Traditional Name: (1R,3S,4S)-3-ammonio-2-keto-4-methyl-cyclobutanesulfonate Formula: C5H9NO4S MolecularWeight: 179.19426

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)C1S(=O)(=O)[O-])[NH3+]

Isomeric SMILES

C[C@H]1[C@@H](C(=O)[C@@H]1S(=O)(=O)[O-])[NH3+]

InChI

InChI=1S/C5H9NO4S/c1-2-3(6)4(7)5(2)11(8,9)10/h2-3,5H,6H2,1H3,(H,8,9,10)/t2-,3-,5+/m0/s1