3-azanyl-2-ethynyl-4-oxidanylidene-azetidine-1-sulfonic acid

Systemtic Name: 3-azanyl-2-ethynyl-4-oxidanylidene-azetidine-1-sulfonic acid Openeye Name: 3-amino-2-ethynyl-4-oxo-azetidine-1-sulfonic acid CAS Name: 3-amino-2-ethynyl-4-oxo-1-azetidinesulfonic acid IUPAC Name: 3-amino-2-ethynyl-4-oxoazetidine-1-sulfonic acid Traditional Name: 3-amino-2-ethynyl-4-keto-azetidine-1-sulfonic acid Formula: C5H6N2O4S MolecularWeight: 190.17714

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1C(C(=O)N1S(=O)(=O)O)N

Isomeric SMILES

C#CC1C(C(=O)N1S(=O)(=O)O)N

InChI

InChI=1S/C5H6N2O4S/c1-2-3-4(6)5(8)7(3)12(9,10)11/h1,3-4H,6H2,(H,9,10,11)