phenyl 9-fluoranyl-3-(2-hydroxyphenyl)-9-azaspiro[4.4]nonane-7-sulfonate

Systemtic Name: phenyl 9-fluoranyl-3-(2-hydroxyphenyl)-9-azaspiro[4.4]nonane-7-sulfonate Openeye Name: phenyl 9-fluoro-3-(2-hydroxyphenyl)-9-azaspiro[4.4]nonane-7-sulfonate CAS Name: 9-fluoro-3-(2-hydroxyphenyl)-9-azaspiro[4.4]nonane-7-sulfonic acid phenyl ester IUPAC Name: phenyl 9-fluoro-3-(2-hydroxyphenyl)-9-azaspiro[4.4]nonane-7-sulfonate Traditional Name: 9-fluoro-3-(2-hydroxyphenyl)-9-azaspiro[4.4]nonane-7-sulfonic acid phenyl ester Formula: C20H22FNO4S MolecularWeight: 391.456383

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CC1C3=CC=CC=C3O)CC(CN2F)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

C1CC2(CC1C3=CC=CC=C3O)CC(CN2F)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C20H22FNO4S/c21-22-14-17(27(24,25)26-16-6-2-1-3-7-16)13-20(22)11-10-15(12-20)18-8-4-5-9-19(18)23/h1-9,15,17,23H,10-14H2