phenyl 10-(2-hydroxyphenyl)-3-(phenylsulfonyl)-10-azaspiro[4.5]decane-6-sulfonate

Systemtic Name: phenyl 10-(2-hydroxyphenyl)-3-(phenylsulfonyl)-10-azaspiro[4.5]decane-6-sulfonate Openeye Name: phenyl 3-(benzenesulfonyl)-10-(2-hydroxyphenyl)-10-azaspiro[4.5]decane-6-sulfonate CAS Name: 3-(benzenesulfonyl)-10-(2-hydroxyphenyl)-10-azaspiro[4.5]decane-6-sulfonic acid phenyl ester IUPAC Name: phenyl 3-(benzenesulfonyl)-10-(2-hydroxyphenyl)-10-azaspiro[4.5]decane-6-sulfonate Traditional Name: 3-besyl-10-(2-hydroxyphenyl)-10-azaspiro[4.5]decane-6-sulfonic acid phenyl ester Formula: C27H29NO6S2 MolecularWeight: 527.65226

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2(CCC(C2)S(=O)(=O)C3=CC=CC=C3)N(C1)C4=CC=CC=C4O)S(=O)(=O)OC5=CC=CC=C5

Isomeric SMILES

C1CC(C2(CCC(C2)S(=O)(=O)C3=CC=CC=C3)N(C1)C4=CC=CC=C4O)S(=O)(=O)OC5=CC=CC=C5

InChI

InChI=1S/C27H29NO6S2/c29-25-15-8-7-14-24(25)28-19-9-16-26(36(32,33)34-21-10-3-1-4-11-21)27(28)18-17-23(20-27)35(30,31)22-12-5-2-6-13-22/h1-8,10-15,23,26,29H,9,16-20H2