(5-methylpyridin-3-yl)methyl 4-methylbenzenesulfonate

Systemtic Name: (5-methylpyridin-3-yl)methyl 4-methylbenzenesulfonate Openeye Name: (5-methyl-3-pyridyl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (5-methyl-3-pyridinyl)methyl ester IUPAC Name: (5-methylpyridin-3-yl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (5-methyl-3-pyridyl)methyl ester Formula: C14H15NO3S MolecularWeight: 277.3388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15NO3S/c1-11-3-5-14(6-4-11)19(16,17)18-10-13-7-12(2)8-15-9-13/h3-9H,10H2,1-2H3