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

Systemtic Name: phenyl 10-(2-hydroxyphenyl)-3-(phenylmethyl)-10-azaspiro[4.5]decane-6-sulfonate Openeye Name: phenyl 3-benzyl-10-(2-hydroxyphenyl)-10-azaspiro[4.5]decane-6-sulfonate CAS Name: 10-(2-hydroxyphenyl)-3-(phenylmethyl)-10-azaspiro[4.5]decane-6-sulfonic acid phenyl ester IUPAC Name: phenyl 3-benzyl-10-(2-hydroxyphenyl)-10-azaspiro[4.5]decane-6-sulfonate Traditional Name: 3-benzyl-10-(2-hydroxyphenyl)-10-azaspiro[4.5]decane-6-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)C4=CC=CC=C4O)S(=O)(=O)OC5=CC=CC=C5

Isomeric SMILES

C1CC(C2(CCC(C2)CC3=CC=CC=C3)N(C1)C4=CC=CC=C4O)S(=O)(=O)OC5=CC=CC=C5

InChI

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