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

Systemtic Name: phenyl 6-(2-hydroxyphenyl)-10-iodanyl-10-azaspiro[4.5]decane-3-sulfonate Openeye Name: phenyl 6-(2-hydroxyphenyl)-10-iodo-10-azaspiro[4.5]decane-3-sulfonate CAS Name: 6-(2-hydroxyphenyl)-10-iodo-10-azaspiro[4.5]decane-3-sulfonic acid phenyl ester IUPAC Name: phenyl 6-(2-hydroxyphenyl)-10-iodo-10-azaspiro[4.5]decane-3-sulfonate Traditional Name: 6-(2-hydroxyphenyl)-10-iodo-10-azaspiro[4.5]decane-3-sulfonic acid phenyl ester Formula: C21H24INO4S MolecularWeight: 513.38903

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2(CCC(C2)S(=O)(=O)OC3=CC=CC=C3)N(C1)I)C4=CC=CC=C4O

Isomeric SMILES

C1CC(C2(CCC(C2)S(=O)(=O)OC3=CC=CC=C3)N(C1)I)C4=CC=CC=C4O

InChI

InChI=1S/C21H24INO4S/c22-23-14-6-10-19(18-9-4-5-11-20(18)24)21(23)13-12-17(15-21)28(25,26)27-16-7-2-1-3-8-16/h1-5,7-9,11,17,19,24H,6,10,12-15H2