(2-pentylphenyl)methyl methanesulfonate

Systemtic Name: (2-pentylphenyl)methyl methanesulfonate Openeye Name: (2-pentylphenyl)methyl methanesulfonate CAS Name: methanesulfonic acid (2-pentylphenyl)methyl ester IUPAC Name: (2-pentylphenyl)methyl methanesulfonate Traditional Name: methanesulfonic acid (2-amylbenzyl) ester Formula: C13H20O3S MolecularWeight: 256.3611

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=CC=C1COS(=O)(=O)C

Isomeric SMILES

CCCCCC1=CC=CC=C1COS(=O)(=O)C

InChI

InChI=1S/C13H20O3S/c1-3-4-5-8-12-9-6-7-10-13(12)11-16-17(2,14)15/h6-7,9-10H,3-5,8,11H2,1-2H3