[1-(methylamino)-1-oxidanylidene-propan-2-yl] 4-bromanyl-3,5-dimethoxy-benzoate

Systemtic Name: [1-(methylamino)-1-oxidanylidene-propan-2-yl] 4-bromanyl-3,5-dimethoxy-benzoate Openeye Name: [1-methyl-2-(methylamino)-2-oxo-ethyl] 4-bromo-3,5-dimethoxy-benzoate CAS Name: 4-bromo-3,5-dimethoxybenzoic acid [1-(methylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(methylamino)-1-oxopropan-2-yl] 4-bromo-3,5-dimethoxybenzoate Traditional Name: 4-bromo-3,5-dimethoxy-benzoic acid [2-keto-1-methyl-2-(methylamino)ethyl] ester Formula: C13H16BrNO5 MolecularWeight: 346.17384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16BrNO5/c1-7(12(16)15-2)20-13(17)8-5-9(18-3)11(14)10(6-8)19-4/h5-7H,1-4H3,(H,15,16)