7,7-dimethyl-6-oxidanylidene-1,2,5-dithiazocane-4-carboxylic acid

Systemtic Name: 7,7-dimethyl-6-oxidanylidene-1,2,5-dithiazocane-4-carboxylic acid Openeye Name: 7,7-dimethyl-6-oxo-1,2,5-dithiazocane-4-carboxylic acid CAS Name: 7,7-dimethyl-6-oxo-1,2,5-dithiazocane-4-carboxylic acid IUPAC Name: 7,7-dimethyl-6-oxo-1,2,5-dithiazocane-4-carboxylic acid Traditional Name: 6-keto-7,7-dimethyl-1,2,5-dithiazocane-4-carboxylic acid Formula: C8H13NO3S2 MolecularWeight: 235.32372

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSSCC(NC1=O)C(=O)O)C

Isomeric SMILES

CC1(CSSCC(NC1=O)C(=O)O)C

InChI

InChI=1S/C8H13NO3S2/c1-8(2)4-14-13-3-5(6(10)11)9-7(8)12/h5H,3-4H2,1-2H3,(H,9,12)(H,10,11)