(1-oxidanylidene-1-phenyl-propan-2-yl) 3-methylsulfonylbenzoate

Systemtic Name: (1-oxidanylidene-1-phenyl-propan-2-yl) 3-methylsulfonylbenzoate Openeye Name: (1-methyl-2-oxo-2-phenyl-ethyl) 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid (1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpropan-2-yl) 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid (2-keto-1-methyl-2-phenyl-ethyl) ester Formula: C17H16O5S MolecularWeight: 332.37094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C17H16O5S/c1-12(16(18)13-7-4-3-5-8-13)22-17(19)14-9-6-10-15(11-14)23(2,20)21/h3-12H,1-2H3