5-oxidanylidene-1,4-thiazepane-3-carboxylic acid

Systemtic Name: 5-oxidanylidene-1,4-thiazepane-3-carboxylic acid Openeye Name: 5-oxo-1,4-thiazepane-3-carboxylic acid CAS Name: 5-oxo-1,4-thiazepane-3-carboxylic acid IUPAC Name: 5-oxo-1,4-thiazepane-3-carboxylic acid Traditional Name: 5-keto-1,4-thiazepane-3-carboxylic acid Formula: C6H9NO3S MolecularWeight: 175.20556

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC(NC1=O)C(=O)O

Isomeric SMILES

C1CSCC(NC1=O)C(=O)O

InChI

InChI=1S/C6H9NO3S/c8-5-1-2-11-3-4(7-5)6(9)10/h4H,1-3H2,(H,7,8)(H,9,10)