2-(2-chlorophenyl)octyl methanesulfonate

Systemtic Name: 2-(2-chlorophenyl)octyl methanesulfonate Openeye Name: 2-(2-chlorophenyl)octyl methanesulfonate CAS Name: methanesulfonic acid 2-(2-chlorophenyl)octyl ester IUPAC Name: 2-(2-chlorophenyl)octyl methanesulfonate Traditional Name: methanesulfonic acid 2-(2-chlorophenyl)octyl ester Formula: C15H23ClO3S MolecularWeight: 318.85932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(COS(=O)(=O)C)C1=CC=CC=C1Cl

Isomeric SMILES

CCCCCCC(COS(=O)(=O)C)C1=CC=CC=C1Cl

InChI

InChI=1S/C15H23ClO3S/c1-3-4-5-6-9-13(12-19-20(2,17)18)14-10-7-8-11-15(14)16/h7-8,10-11,13H,3-6,9,12H2,1-2H3