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

Systemtic Name: phenyl 7-ethoxy-9-(2-hydroxyphenyl)-9-azaspiro[4.4]nonane-3-sulfonate Openeye Name: phenyl 7-ethoxy-9-(2-hydroxyphenyl)-9-azaspiro[4.4]nonane-3-sulfonate CAS Name: 7-ethoxy-9-(2-hydroxyphenyl)-9-azaspiro[4.4]nonane-3-sulfonic acid phenyl ester IUPAC Name: phenyl 7-ethoxy-9-(2-hydroxyphenyl)-9-azaspiro[4.4]nonane-3-sulfonate Traditional Name: 7-ethoxy-9-(2-hydroxyphenyl)-9-azaspiro[4.4]nonane-3-sulfonic acid phenyl ester Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CC2(CCC(C2)S(=O)(=O)OC3=CC=CC=C3)N(C1)C4=CC=CC=C4O

Isomeric SMILES

CCOC1CC2(CCC(C2)S(=O)(=O)OC3=CC=CC=C3)N(C1)C4=CC=CC=C4O

InChI

InChI=1S/C22H27NO5S/c1-2-27-18-14-22(23(16-18)20-10-6-7-11-21(20)24)13-12-19(15-22)29(25,26)28-17-8-4-3-5-9-17/h3-11,18-19,24H,2,12-16H2,1H3