(3-methylphenyl)methyl 2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: (3-methylphenyl)methyl 2-methyl-5-methylsulfonyl-benzoate Openeye Name: m-tolylmethyl 2-methyl-5-methylsulfonyl-benzoate CAS Name: 2-methyl-5-methylsulfonylbenzoic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 2-methyl-5-methylsulfonylbenzoate Traditional Name: 5-mesyl-2-methyl-benzoic acid (3-methylbenzyl) ester Formula: C17H18O4S MolecularWeight: 318.38742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC=C1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)C)C

InChI

InChI=1S/C17H18O4S/c1-12-5-4-6-14(9-12)11-21-17(18)16-10-15(22(3,19)20)8-7-13(16)2/h4-10H,11H2,1-3H3