1-(2,4-dichlorophenyl)hexan-2-yl methanesulfonate

Systemtic Name: 1-(2,4-dichlorophenyl)hexan-2-yl methanesulfonate Openeye Name: 1-[(2,4-dichlorophenyl)methyl]pentyl methanesulfonate CAS Name: methanesulfonic acid 1-(2,4-dichlorophenyl)hexan-2-yl ester IUPAC Name: 1-(2,4-dichlorophenyl)hexan-2-yl methanesulfonate Traditional Name: methanesulfonic acid 1-(2,4-dichlorobenzyl)pentyl ester Formula: C13H18Cl2O3S MolecularWeight: 325.25122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC1=C(C=C(C=C1)Cl)Cl)OS(=O)(=O)C

Isomeric SMILES

CCCCC(CC1=C(C=C(C=C1)Cl)Cl)OS(=O)(=O)C

InChI

InChI=1S/C13H18Cl2O3S/c1-3-4-5-12(18-19(2,16)17)8-10-6-7-11(14)9-13(10)15/h6-7,9,12H,3-5,8H2,1-2H3