[(2R)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-bromanyl-4-methoxy-benzoate

Systemtic Name: [(2R)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-bromanyl-4-methoxy-benzoate Openeye Name: [(1R)-1-methyl-2-(methylcarbamoylamino)-2-oxo-ethyl] 3-bromo-4-methoxy-benzoate CAS Name: 3-bromo-4-methoxybenzoic acid [(2R)-1-(methylcarbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(methylcarbamoylamino)-1-oxopropan-2-yl] 3-bromo-4-methoxybenzoate Traditional Name: 3-bromo-4-methoxy-benzoic acid [(1R)-2-keto-1-methyl-2-(methylcarbamoylamino)ethyl] ester Formula: C13H15BrN2O5 MolecularWeight: 359.1726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15BrN2O5/c1-7(11(17)16-13(19)15-2)21-12(18)8-4-5-10(20-3)9(14)6-8/h4-7H,1-3H3,(H2,15,16,17,19)/t7-/m1/s1