8-(4-carboxyphenoxy)-1-(4-oxidanyl-4-oxidanylidene-butanoyl)-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid

Systemtic Name: 8-(4-carboxyphenoxy)-1-(4-oxidanyl-4-oxidanylidene-butanoyl)-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid Openeye Name: 8-(4-carboxyphenoxy)-1-(4-hydroxy-4-oxo-butanoyl)-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid CAS Name: 8-(4-carboxyphenoxy)-1-(4-hydroxy-1,4-dioxobutyl)-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid IUPAC Name: 8-(4-carboxyphenoxy)-1-(4-hydroxy-4-oxobutanoyl)-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid Traditional Name: 8-(4-carboxyphenoxy)-1-(4-hydroxy-4-keto-butanoyl)-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid Formula: C20H23NO8S MolecularWeight: 437.46352

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCC1OC3=CC=C(C=C3)C(=O)O)N(C(CS2)C(=O)O)C(=O)CCC(=O)O

Isomeric SMILES

C1CC2(CCC1OC3=CC=C(C=C3)C(=O)O)N(C(CS2)C(=O)O)C(=O)CCC(=O)O

InChI

InChI=1S/C20H23NO8S/c22-16(5-6-17(23)24)21-15(19(27)28)11-30-20(21)9-7-14(8-10-20)29-13-3-1-12(2-4-13)18(25)26/h1-4,14-15H,5-11H2,(H,23,24)(H,25,26)(H,27,28)