[(1R)-1-phenylethyl] 2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: [(1R)-1-phenylethyl] 2-methyl-5-methylsulfonyl-benzoate Openeye Name: [(1R)-1-phenylethyl] 2-methyl-5-methylsulfonyl-benzoate CAS Name: 2-methyl-5-methylsulfonylbenzoic acid [(1R)-1-phenylethyl] ester IUPAC Name: [(1R)-1-phenylethyl] 2-methyl-5-methylsulfonylbenzoate Traditional Name: 5-mesyl-2-methyl-benzoic acid [(1R)-1-phenylethyl] ester Formula: C17H18O4S MolecularWeight: 318.38742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)O[C@H](C)C2=CC=CC=C2

InChI

InChI=1S/C17H18O4S/c1-12-9-10-15(22(3,19)20)11-16(12)17(18)21-13(2)14-7-5-4-6-8-14/h4-11,13H,1-3H3/t13-/m1/s1