4-[(9,9-dimethyl-6-oxidanylidene-7-oxa-10-azaspiro[4.5]decan-10-yl)sulfonyl]benzoic acid

Systemtic Name: 4-[(9,9-dimethyl-6-oxidanylidene-7-oxa-10-azaspiro[4.5]decan-10-yl)sulfonyl]benzoic acid Openeye Name: 4-[(9,9-dimethyl-6-oxo-7-oxa-10-azaspiro[4.5]decan-10-yl)sulfonyl]benzoic acid CAS Name: 4-[(9,9-dimethyl-6-oxo-7-oxa-10-azaspiro[4.5]decan-10-yl)sulfonyl]benzoic acid IUPAC Name: 4-[(9,9-dimethyl-6-oxo-7-oxa-10-azaspiro[4.5]decan-10-yl)sulfonyl]benzoic acid Traditional Name: 4-[(6-keto-9,9-dimethyl-7-oxa-10-azaspiro[4.5]decan-10-yl)sulfonyl]benzoic acid Formula: C17H21NO6S MolecularWeight: 367.41674

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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)CCCC2)C

Isomeric SMILES

CC1(COC(=O)C2(N1S(=O)(=O)C3=CC=C(C=C3)C(=O)O)CCCC2)C

InChI

InChI=1S/C17H21NO6S/c1-16(2)11-24-15(21)17(9-3-4-10-17)18(16)25(22,23)13-7-5-12(6-8-13)14(19)20/h5-8H,3-4,9-11H2,1-2H3,(H,19,20)