(4-propan-2-ylphenyl)methyl 2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: (4-propan-2-ylphenyl)methyl 2-methyl-5-methylsulfonyl-benzoate Openeye Name: (4-isopropylphenyl)methyl 2-methyl-5-methylsulfonyl-benzoate CAS Name: 2-methyl-5-methylsulfonylbenzoic acid (4-propan-2-ylphenyl)methyl ester IUPAC Name: (4-propan-2-ylphenyl)methyl 2-methyl-5-methylsulfonylbenzoate Traditional Name: 5-mesyl-2-methyl-benzoic acid (4-isopropylbenzyl) ester Formula: C19H22O4S MolecularWeight: 346.44058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C19H22O4S/c1-13(2)16-8-6-15(7-9-16)12-23-19(20)18-11-17(24(4,21)22)10-5-14(18)3/h5-11,13H,12H2,1-4H3