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

Systemtic Name: phenyl 3-(2-hydroxyphenyl)-7-methoxy-9-azaspiro[4.4]nonane-9-sulfonate Openeye Name: phenyl 3-(2-hydroxyphenyl)-7-methoxy-9-azaspiro[4.4]nonane-9-sulfonate CAS Name: 3-(2-hydroxyphenyl)-7-methoxy-9-azaspiro[4.4]nonane-9-sulfonic acid phenyl ester IUPAC Name: phenyl 3-(2-hydroxyphenyl)-7-methoxy-9-azaspiro[4.4]nonane-9-sulfonate Traditional Name: 3-(2-hydroxyphenyl)-7-methoxy-9-azaspiro[4.4]nonane-9-sulfonic acid phenyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC2(CCC(C2)C3=CC=CC=C3O)N(C1)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

COC1CC2(CCC(C2)C3=CC=CC=C3O)N(C1)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C21H25NO5S/c1-26-18-14-21(12-11-16(13-21)19-9-5-6-10-20(19)23)22(15-18)28(24,25)27-17-7-3-2-4-8-17/h2-10,16,18,23H,11-15H2,1H3