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

Systemtic Name: phenyl 9-(2-hydroxyphenyl)-7-propan-2-ylsulfonyl-9-azaspiro[4.4]nonane-3-sulfonate Openeye Name: phenyl 9-(2-hydroxyphenyl)-7-isopropylsulfonyl-9-azaspiro[4.4]nonane-3-sulfonate CAS Name: 9-(2-hydroxyphenyl)-7-propan-2-ylsulfonyl-9-azaspiro[4.4]nonane-3-sulfonic acid phenyl ester IUPAC Name: phenyl 9-(2-hydroxyphenyl)-7-propan-2-ylsulfonyl-9-azaspiro[4.4]nonane-3-sulfonate Traditional Name: 9-(2-hydroxyphenyl)-7-isopropylsulfonyl-9-azaspiro[4.4]nonane-3-sulfonic acid phenyl ester Formula: C23H29NO6S2 MolecularWeight: 479.60946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1CC2(CCC(C2)S(=O)(=O)OC3=CC=CC=C3)N(C1)C4=CC=CC=C4O

Isomeric SMILES

CC(C)S(=O)(=O)C1CC2(CCC(C2)S(=O)(=O)OC3=CC=CC=C3)N(C1)C4=CC=CC=C4O

InChI

InChI=1S/C23H29NO6S2/c1-17(2)31(26,27)20-15-23(24(16-20)21-10-6-7-11-22(21)25)13-12-19(14-23)32(28,29)30-18-8-4-3-5-9-18/h3-11,17,19-20,25H,12-16H2,1-2H3