2-acetamidoethyl-[[3-[bis(fluoranyl)methoxy]-4-methoxy-phenyl]methyl]azanium

Systemtic Name: 2-acetamidoethyl-[[3-[bis(fluoranyl)methoxy]-4-methoxy-phenyl]methyl]azanium Openeye Name: 2-acetamidoethyl-[[3-(difluoromethoxy)-4-methoxy-phenyl]methyl]ammonium CAS Name: 2-acetamidoethyl-[[3-(difluoromethoxy)-4-methoxyphenyl]methyl]ammonium IUPAC Name: 2-acetamidoethyl-[[3-(difluoromethoxy)-4-methoxyphenyl]methyl]azanium Traditional Name: 2-acetamidoethyl-[3-(difluoromethoxy)-4-methoxy-benzyl]ammonium Formula: C13H19F2N2O3+ MolecularWeight: 289.298366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC[NH2+]CC1=CC(=C(C=C1)OC)OC(F)F

Isomeric SMILES

CC(=O)NCC[NH2+]CC1=CC(=C(C=C1)OC)OC(F)F

InChI

InChI=1S/C13H18F2N2O3/c1-9(18)17-6-5-16-8-10-3-4-11(19-2)12(7-10)20-13(14)15/h3-4,7,13,16H,5-6,8H2,1-2H3,(H,17,18)/p+1