(2-chloranylpyridin-3-yl) 4-methylbenzenesulfonate

Systemtic Name: (2-chloranylpyridin-3-yl) 4-methylbenzenesulfonate Openeye Name: (2-chloro-3-pyridyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-chloro-3-pyridinyl) ester IUPAC Name: (2-chloropyridin-3-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-chloro-3-pyridyl) ester Formula: C12H10ClNO3S MolecularWeight: 283.7307

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(N=CC=C2)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(N=CC=C2)Cl

InChI

InChI=1S/C12H10ClNO3S/c1-9-4-6-10(7-5-9)18(15,16)17-11-3-2-8-14-12(11)13/h2-8H,1H3