phenyl 5-methylsulfonylpyridine-3-carboxylate

Systemtic Name: phenyl 5-methylsulfonylpyridine-3-carboxylate Openeye Name: phenyl 5-methylsulfonylpyridine-3-carboxylate CAS Name: 5-methylsulfonyl-3-pyridinecarboxylic acid phenyl ester IUPAC Name: phenyl 5-methylsulfonylpyridine-3-carboxylate Traditional Name: 5-mesylnicotinic acid phenyl ester Formula: C13H11NO4S MolecularWeight: 277.29574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CN=CC(=C1)C(=O)OC2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)C1=CN=CC(=C1)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C13H11NO4S/c1-19(16,17)12-7-10(8-14-9-12)13(15)18-11-5-3-2-4-6-11/h2-9H,1H3