4-[(10,10-dimethyl-7-oxidanylidene-8-oxa-11-azaspiro[5.5]undecan-11-yl)sulfonyl]benzoic acid

Systemtic Name: 4-[(10,10-dimethyl-7-oxidanylidene-8-oxa-11-azaspiro[5.5]undecan-11-yl)sulfonyl]benzoic acid Openeye Name: 4-[(10,10-dimethyl-7-oxo-8-oxa-11-azaspiro[5.5]undecan-11-yl)sulfonyl]benzoic acid CAS Name: 4-[(10,10-dimethyl-7-oxo-8-oxa-11-azaspiro[5.5]undecan-11-yl)sulfonyl]benzoic acid IUPAC Name: 4-[(10,10-dimethyl-7-oxo-8-oxa-11-azaspiro[5.5]undecan-11-yl)sulfonyl]benzoic acid Traditional Name: 4-[(7-keto-10,10-dimethyl-8-oxa-11-azaspiro[5.5]undecan-11-yl)sulfonyl]benzoic acid Formula: C18H23NO6S MolecularWeight: 381.44332

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(=O)C2(N1S(=O)(=O)C3=CC=C(C=C3)C(=O)O)CCCCC2)C

Isomeric SMILES

CC1(COC(=O)C2(N1S(=O)(=O)C3=CC=C(C=C3)C(=O)O)CCCCC2)C

InChI

InChI=1S/C18H23NO6S/c1-17(2)12-25-16(22)18(10-4-3-5-11-18)19(17)26(23,24)14-8-6-13(7-9-14)15(20)21/h6-9H,3-5,10-12H2,1-2H3,(H,20,21)