(phenylmethyl) 3-(4-methylphenyl)sulfonylpropanoate

Systemtic Name: (phenylmethyl) 3-(4-methylphenyl)sulfonylpropanoate Openeye Name: benzyl 3-(p-tolylsulfonyl)propanoate CAS Name: 3-(4-methylphenyl)sulfonylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(4-methylphenyl)sulfonylpropanoate Traditional Name: 3-tosylpropionic acid benzyl ester Formula: C17H18O4S MolecularWeight: 318.38742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18O4S/c1-14-7-9-16(10-8-14)22(19,20)12-11-17(18)21-13-15-5-3-2-4-6-15/h2-10H,11-13H2,1H3