methyl 4,4-bis(fluoranyl)-4-phenylsulfanyl-2-(tributylstannylmethyl)butanoate

Systemtic Name: methyl 4,4-bis(fluoranyl)-4-phenylsulfanyl-2-(tributylstannylmethyl)butanoate Openeye Name: methyl 4,4-difluoro-4-phenylsulfanyl-2-(tributylstannylmethyl)butanoate CAS Name: 4,4-difluoro-4-(phenylthio)-2-(tributylstannylmethyl)butanoic acid methyl ester IUPAC Name: methyl 4,4-difluoro-4-phenylsulfanyl-2-(tributylstannylmethyl)butanoate Traditional Name: 4,4-difluoro-4-(phenylthio)-2-(tributylstannylmethyl)butyric acid methyl ester Formula: C24H40F2O2SSn MolecularWeight: 549.345006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn](CCCC)(CCCC)CC(CC(F)(F)SC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CCCC[Sn](CCCC)(CCCC)CC(CC(F)(F)SC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C12H13F2O2S.3C4H9.Sn/c1-9(11(15)16-2)8-12(13,14)17-10-6-4-3-5-7-10;3*1-3-4-2;/h3-7,9H,1,8H2,2H3;3*1,3-4H2,2H3;