6,9-bis(oxidanylidene)-3-(3-sulfanylpropanoyl)-3-azaspiro[4.4]nonane-2-carboxylic acid

Systemtic Name: 6,9-bis(oxidanylidene)-3-(3-sulfanylpropanoyl)-3-azaspiro[4.4]nonane-2-carboxylic acid Openeye Name: 6,9-dioxo-3-(3-sulfanylpropanoyl)-3-azaspiro[4.4]nonane-2-carboxylic acid CAS Name: 3-(3-mercapto-1-oxopropyl)-6,9-dioxo-3-azaspiro[4.4]nonane-2-carboxylic acid IUPAC Name: 6,9-dioxo-3-(3-sulfanylpropanoyl)-3-azaspiro[4.4]nonane-2-carboxylic acid Traditional Name: 6,9-diketo-3-(3-mercaptopropanoyl)-3-azaspiro[4.4]nonane-2-carboxylic acid Formula: C12H15NO5S MolecularWeight: 285.3162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C2(C1=O)CC(N(C2)C(=O)CCS)C(=O)O

Isomeric SMILES

C1CC(=O)C2(C1=O)CC(N(C2)C(=O)CCS)C(=O)O

InChI

InChI=1S/C12H15NO5S/c14-8-1-2-9(15)12(8)5-7(11(17)18)13(6-12)10(16)3-4-19/h7,19H,1-6H2,(H,17,18)