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

Systemtic Name: phenyl 10-bromanyl-3-(2-hydroxyphenyl)-10-azaspiro[4.5]decane-6-sulfonate Openeye Name: phenyl 10-bromo-3-(2-hydroxyphenyl)-10-azaspiro[4.5]decane-6-sulfonate CAS Name: 10-bromo-3-(2-hydroxyphenyl)-10-azaspiro[4.5]decane-6-sulfonic acid phenyl ester IUPAC Name: phenyl 10-bromo-3-(2-hydroxyphenyl)-10-azaspiro[4.5]decane-6-sulfonate Traditional Name: 10-bromo-3-(2-hydroxyphenyl)-10-azaspiro[4.5]decane-6-sulfonic acid phenyl ester Formula: C21H24BrNO4S MolecularWeight: 466.38856

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2(CCC(C2)C3=CC=CC=C3O)N(C1)Br)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

C1CC(C2(CCC(C2)C3=CC=CC=C3O)N(C1)Br)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C21H24BrNO4S/c22-23-14-6-11-20(28(25,26)27-17-7-2-1-3-8-17)21(23)13-12-16(15-21)18-9-4-5-10-19(18)24/h1-5,7-10,16,20,24H,6,11-15H2