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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1CC2(CCC(C2)C3=CC=CC=C3O)N(C1)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CCOC1CC2(CCC(C2)C3=CC=CC=C3O)N(C1)S(=O)(=O)OC4=CC=CC=C4

InChI

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