pyridin-2-yl 2,3,4-trimethylbenzenesulfonate

Systemtic Name: pyridin-2-yl 2,3,4-trimethylbenzenesulfonate Openeye Name: 2-pyridyl 2,3,4-trimethylbenzenesulfonate CAS Name: 2,3,4-trimethylbenzenesulfonic acid 2-pyridinyl ester IUPAC Name: pyridin-2-yl 2,3,4-trimethylbenzenesulfonate Traditional Name: 2,3,4-trimethylbenzenesulfonic acid 2-pyridyl ester Formula: C14H15NO3S MolecularWeight: 277.3388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)S(=O)(=O)OC2=CC=CC=N2)C)C

Isomeric SMILES

CC1=C(C(=C(C=C1)S(=O)(=O)OC2=CC=CC=N2)C)C

InChI

InChI=1S/C14H15NO3S/c1-10-7-8-13(12(3)11(10)2)19(16,17)18-14-6-4-5-9-15-14/h4-9H,1-3H3