pyridin-2-ylmethyl 3-(4-methylphenyl)sulfonylpropanoate

Systemtic Name: pyridin-2-ylmethyl 3-(4-methylphenyl)sulfonylpropanoate Openeye Name: 2-pyridylmethyl 3-(p-tolylsulfonyl)propanoate CAS Name: 3-(4-methylphenyl)sulfonylpropanoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 3-(4-methylphenyl)sulfonylpropanoate Traditional Name: 3-tosylpropionic acid 2-pyridylmethyl ester Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)OCC2=CC=CC=N2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)OCC2=CC=CC=N2

InChI

InChI=1S/C16H17NO4S/c1-13-5-7-15(8-6-13)22(19,20)11-9-16(18)21-12-14-4-2-3-10-17-14/h2-8,10H,9,11-12H2,1H3