(2,5-dimethylphenyl)methyl 3-(4-methylphenyl)sulfonylpropanoate

Systemtic Name: (2,5-dimethylphenyl)methyl 3-(4-methylphenyl)sulfonylpropanoate Openeye Name: (2,5-dimethylphenyl)methyl 3-(p-tolylsulfonyl)propanoate CAS Name: 3-(4-methylphenyl)sulfonylpropanoic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 3-(4-methylphenyl)sulfonylpropanoate Traditional Name: 3-tosylpropionic acid (2,5-dimethylbenzyl) ester Formula: C19H22O4S MolecularWeight: 346.44058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22O4S/c1-14-5-8-18(9-6-14)24(21,22)11-10-19(20)23-13-17-12-15(2)4-7-16(17)3/h4-9,12H,10-11,13H2,1-3H3