phenyl 4-methoxy-11-methylsulfanyl-11-azaspiro[5.5]undecane-10-sulfonate

Systemtic Name: phenyl 4-methoxy-11-methylsulfanyl-11-azaspiro[5.5]undecane-10-sulfonate Openeye Name: phenyl 4-methoxy-11-methylsulfanyl-11-azaspiro[5.5]undecane-10-sulfonate CAS Name: 4-methoxy-11-(methylthio)-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester IUPAC Name: phenyl 4-methoxy-11-methylsulfanyl-11-azaspiro[5.5]undecane-10-sulfonate Traditional Name: 4-methoxy-11-(methylthio)-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester Formula: C18H27NO4S2 MolecularWeight: 385.54128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1CCCC2(C1)CCCC(N2SC)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

COC1CCCC2(C1)CCCC(N2SC)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C18H27NO4S2/c1-22-16-10-6-12-18(14-16)13-7-11-17(19(18)24-2)25(20,21)23-15-8-4-3-5-9-15/h3-5,8-9,16-17H,6-7,10-14H2,1-2H3