(2-phenyl-1-sulfonyl-heptan-3-yl) methanesulfonate

Systemtic Name: (2-phenyl-1-sulfonyl-heptan-3-yl) methanesulfonate Openeye Name: 1-(1-phenyl-2-sulfonyl-ethyl)pentyl methanesulfonate CAS Name: methanesulfonic acid (2-phenyl-1-sulfonylheptan-3-yl) ester IUPAC Name: (2-phenyl-1-sulfonylheptan-3-yl) methanesulfonate Traditional Name: methanesulfonic acid 1-(1-phenyl-2-sulfonyl-ethyl)pentyl ester Formula: C14H20O5S2 MolecularWeight: 332.4356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C=S(=O)=O)C1=CC=CC=C1)OS(=O)(=O)C

Isomeric SMILES

CCCCC(C(C=S(=O)=O)C1=CC=CC=C1)OS(=O)(=O)C

InChI

InChI=1S/C14H20O5S2/c1-3-4-10-14(19-21(2,17)18)13(11-20(15)16)12-8-6-5-7-9-12/h5-9,11,13-14H,3-4,10H2,1-2H3