[2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 3-methylsulfonylbenzoate

Systemtic Name: [2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 3-methylsulfonylbenzoate Openeye Name: (2-oxo-2-ureido-ethyl) 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid [2-(carbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(carbamoylamino)-2-oxoethyl] 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid (2-keto-2-ureido-ethyl) ester Formula: C11H12N2O6S MolecularWeight: 300.28778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC(=O)NC(=O)N

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC(=O)NC(=O)N

InChI

InChI=1S/C11H12N2O6S/c1-20(17,18)8-4-2-3-7(5-8)10(15)19-6-9(14)13-11(12)16/h2-5H,6H2,1H3,(H3,12,13,14,16)