[1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-methylsulfonylbenzoate

Systemtic Name: [1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-methylsulfonylbenzoate Openeye Name: [1-methyl-2-(methylcarbamoylamino)-2-oxo-ethyl] 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid [1-(methylcarbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(methylcarbamoylamino)-1-oxopropan-2-yl] 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid [2-keto-1-methyl-2-(methylcarbamoylamino)ethyl] ester Formula: C13H16N2O6S MolecularWeight: 328.34094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O6S/c1-8(11(16)15-13(18)14-2)21-12(17)9-5-4-6-10(7-9)22(3,19)20/h4-8H,1-3H3,(H2,14,15,16,18)