phenyl 4-bromanyl-11-(phenylsulfonyl)-11-azaspiro[5.5]undecane-10-sulfonate

Systemtic Name: phenyl 4-bromanyl-11-(phenylsulfonyl)-11-azaspiro[5.5]undecane-10-sulfonate Openeye Name: phenyl 11-(benzenesulfonyl)-4-bromo-11-azaspiro[5.5]undecane-10-sulfonate CAS Name: 11-(benzenesulfonyl)-4-bromo-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester IUPAC Name: phenyl 11-(benzenesulfonyl)-4-bromo-11-azaspiro[5.5]undecane-10-sulfonate Traditional Name: 11-besyl-4-bromo-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester Formula: C22H26BrNO5S2 MolecularWeight: 528.47954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC2(C1)CCCC(N2S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4)Br

Isomeric SMILES

C1CC(CC2(C1)CCCC(N2S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4)Br

InChI

InChI=1S/C22H26BrNO5S2/c23-18-9-7-15-22(17-18)16-8-14-21(31(27,28)29-19-10-3-1-4-11-19)24(22)30(25,26)20-12-5-2-6-13-20/h1-6,10-13,18,21H,7-9,14-17H2