4-[methyl(phenyl)phosphoryl]butyl methanesulfonate

Systemtic Name: 4-[methyl(phenyl)phosphoryl]butyl methanesulfonate Openeye Name: 4-[methyl(phenyl)phosphoryl]butyl methanesulfonate CAS Name: methanesulfonic acid 4-[methyl(phenyl)phosphoryl]butyl ester IUPAC Name: 4-[methyl(phenyl)phosphoryl]butyl methanesulfonate Traditional Name: methanesulfonic acid 4-[methyl(phenyl)phosphoryl]butyl ester Formula: C12H19O4PS MolecularWeight: 290.315621

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CP(=O)(CCCCOS(=O)(=O)C)C1=CC=CC=C1

Isomeric SMILES

CP(=O)(CCCCOS(=O)(=O)C)C1=CC=CC=C1

InChI

InChI=1S/C12H19O4PS/c1-17(13,12-8-4-3-5-9-12)11-7-6-10-16-18(2,14)15/h3-5,8-9H,6-7,10-11H2,1-2H3