1-(5-ethylpyridin-2-yl)ethyl 4-methylbenzenesulfonate

Systemtic Name: 1-(5-ethylpyridin-2-yl)ethyl 4-methylbenzenesulfonate Openeye Name: 1-(5-ethyl-2-pyridyl)ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 1-(5-ethyl-2-pyridinyl)ethyl ester IUPAC Name: 1-(5-ethylpyridin-2-yl)ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 1-(5-ethyl-2-pyridyl)ethyl ester Formula: C16H19NO3S MolecularWeight: 305.39196

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)C(C)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCC1=CN=C(C=C1)C(C)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C16H19NO3S/c1-4-14-7-10-16(17-11-14)13(3)20-21(18,19)15-8-5-12(2)6-9-15/h5-11,13H,4H2,1-3H3