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

Systemtic Name: phenyl 6-(2-hydroxyphenyl)-3-(phenylmethyl)-10-azaspiro[4.5]decane-10-sulfonate Openeye Name: phenyl 3-benzyl-6-(2-hydroxyphenyl)-10-azaspiro[4.5]decane-10-sulfonate CAS Name: 6-(2-hydroxyphenyl)-3-(phenylmethyl)-10-azaspiro[4.5]decane-10-sulfonic acid phenyl ester IUPAC Name: phenyl 3-benzyl-6-(2-hydroxyphenyl)-10-azaspiro[4.5]decane-10-sulfonate Traditional Name: 3-benzyl-6-(2-hydroxyphenyl)-10-azaspiro[4.5]decane-10-sulfonic acid phenyl ester Formula: C28H31NO4S MolecularWeight: 477.61504

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2(CCC(C2)CC3=CC=CC=C3)N(C1)S(=O)(=O)OC4=CC=CC=C4)C5=CC=CC=C5O

Isomeric SMILES

C1CC(C2(CCC(C2)CC3=CC=CC=C3)N(C1)S(=O)(=O)OC4=CC=CC=C4)C5=CC=CC=C5O

InChI

InChI=1S/C28H31NO4S/c30-27-16-8-7-14-25(27)26-15-9-19-29(34(31,32)33-24-12-5-2-6-13-24)28(26)18-17-23(21-28)20-22-10-3-1-4-11-22/h1-8,10-14,16,23,26,30H,9,15,17-21H2