[(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-(methylsulfonylmethyl)benzoate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-(methylsulfonylmethyl)benzoate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] 3-(methylsulfonylmethyl)benzoate CAS Name: 3-(methylsulfonylmethyl)benzoic acid [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 3-(methylsulfonylmethyl)benzoate Traditional Name: 3-(mesylmethyl)benzoic acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C15H20N2O6S MolecularWeight: 356.3941

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)[C@H](C(=O)NC(=O)N)OC(=O)C1=CC(=CC=C1)CS(=O)(=O)C

InChI

InChI=1S/C15H20N2O6S/c1-9(2)12(13(18)17-15(16)20)23-14(19)11-6-4-5-10(7-11)8-24(3,21)22/h4-7,9,12H,8H2,1-3H3,(H3,16,17,18,20)/t12-/m1/s1