pyridin-2-ylmethyl 2-chloranyl-5-methylsulfonyl-benzoate

Systemtic Name: pyridin-2-ylmethyl 2-chloranyl-5-methylsulfonyl-benzoate Openeye Name: 2-pyridylmethyl 2-chloro-5-methylsulfonyl-benzoate CAS Name: 2-chloro-5-methylsulfonylbenzoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 2-chloro-5-methylsulfonylbenzoate Traditional Name: 2-chloro-5-mesyl-benzoic acid 2-pyridylmethyl ester Formula: C14H12ClNO4S MolecularWeight: 325.76738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCC2=CC=CC=N2

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCC2=CC=CC=N2

InChI

InChI=1S/C14H12ClNO4S/c1-21(18,19)11-5-6-13(15)12(8-11)14(17)20-9-10-4-2-3-7-16-10/h2-8H,9H2,1H3