[2-[(4-chlorophenyl)methyl]-3-methylsulfonyloxy-propyl] ethanoate

Systemtic Name: [2-[(4-chlorophenyl)methyl]-3-methylsulfonyloxy-propyl] ethanoate Openeye Name: [2-[(4-chlorophenyl)methyl]-3-methylsulfonyloxy-propyl] acetate CAS Name: acetic acid [2-[(4-chlorophenyl)methyl]-3-methylsulfonyloxypropyl] ester IUPAC Name: [2-[(4-chlorophenyl)methyl]-3-methylsulfonyloxypropyl] acetate Traditional Name: acetic acid [2-(4-chlorobenzyl)-3-methylsulfonyloxy-propyl] ester Formula: C13H17ClO5S MolecularWeight: 320.78908

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CC1=CC=C(C=C1)Cl)COS(=O)(=O)C

Isomeric SMILES

CC(=O)OCC(CC1=CC=C(C=C1)Cl)COS(=O)(=O)C

InChI

InChI=1S/C13H17ClO5S/c1-10(15)18-8-12(9-19-20(2,16)17)7-11-3-5-13(14)6-4-11/h3-6,12H,7-9H2,1-2H3