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

Systemtic Name: 8-(4-carboxyphenoxy)-1-(phenylcarbonyl)-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid Openeye Name: 1-benzoyl-8-(4-carboxyphenoxy)-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid CAS Name: 1-benzoyl-8-(4-carboxyphenoxy)-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid IUPAC Name: 1-benzoyl-8-(4-carboxyphenoxy)-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid Traditional Name: 1-benzoyl-8-(4-carboxyphenoxy)-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid Formula: C23H23NO6S MolecularWeight: 441.49682

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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)C4=CC=CC=C4

Isomeric SMILES

C1CC2(CCC1OC3=CC=C(C=C3)C(=O)O)N(C(CS2)C(=O)O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H23NO6S/c25-20(15-4-2-1-3-5-15)24-19(22(28)29)14-31-23(24)12-10-18(11-13-23)30-17-8-6-16(7-9-17)21(26)27/h1-9,18-19H,10-14H2,(H,26,27)(H,28,29)