8-(2,3-dimethyl-4-oxidanyl-4-oxidanylidene-butanoyl)-3,4-dithia-8-azaspiro[4.4]nonane-7-carboxylic acid

Systemtic Name: 8-(2,3-dimethyl-4-oxidanyl-4-oxidanylidene-butanoyl)-3,4-dithia-8-azaspiro[4.4]nonane-7-carboxylic acid Openeye Name: 8-(4-hydroxy-2,3-dimethyl-4-oxo-butanoyl)-3,4-dithia-8-azaspiro[4.4]nonane-7-carboxylic acid CAS Name: 8-(4-hydroxy-2,3-dimethyl-1,4-dioxobutyl)-3,4-dithia-8-azaspiro[4.4]nonane-7-carboxylic acid IUPAC Name: 8-(4-hydroxy-2,3-dimethyl-4-oxobutanoyl)-3,4-dithia-8-azaspiro[4.4]nonane-7-carboxylic acid Traditional Name: 8-(4-hydroxy-4-keto-2,3-dimethyl-butanoyl)-3,4-dithia-8-azaspiro[4.4]nonane-7-carboxylic acid Formula: C13H19NO5S2 MolecularWeight: 333.42366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)C(=O)O)C(=O)N1CC2(CCSS2)CC1C(=O)O

Isomeric SMILES

CC(C(C)C(=O)O)C(=O)N1CC2(CCSS2)CC1C(=O)O

InChI

InChI=1S/C13H19NO5S2/c1-7(8(2)11(16)17)10(15)14-6-13(3-4-20-21-13)5-9(14)12(18)19/h7-9H,3-6H2,1-2H3,(H,16,17)(H,18,19)