4-(5-oxidanylidene-4H-1,2-oxazol-3-yl)butane-1-sulfonic acid

Systemtic Name: 4-(5-oxidanylidene-4H-1,2-oxazol-3-yl)butane-1-sulfonic acid Openeye Name: 4-(5-oxo-4H-isoxazol-3-yl)butane-1-sulfonic acid CAS Name: 4-(5-oxo-4H-isoxazol-3-yl)-1-butanesulfonic acid IUPAC Name: 4-(5-oxo-4H-1,2-oxazol-3-yl)butane-1-sulfonic acid Traditional Name: 4-(5-keto-2-isoxazolin-3-yl)butane-1-sulfonic acid Formula: C7H11NO5S MolecularWeight: 221.23094

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NOC1=O)CCCCS(=O)(=O)O

Isomeric SMILES

C1C(=NOC1=O)CCCCS(=O)(=O)O

InChI

InChI=1S/C7H11NO5S/c9-7-5-6(8-13-7)3-1-2-4-14(10,11)12/h1-5H2,(H,10,11,12)