(4,5-dimethoxy-2-nitro-phenyl)methyl-[2-(3-fluorophenyl)ethyl]azanium

Systemtic Name: (4,5-dimethoxy-2-nitro-phenyl)methyl-[2-(3-fluorophenyl)ethyl]azanium Openeye Name: (4,5-dimethoxy-2-nitro-phenyl)methyl-[2-(3-fluorophenyl)ethyl]ammonium CAS Name: (4,5-dimethoxy-2-nitrophenyl)methyl-[2-(3-fluorophenyl)ethyl]ammonium IUPAC Name: (4,5-dimethoxy-2-nitrophenyl)methyl-[2-(3-fluorophenyl)ethyl]azanium Traditional Name: (4,5-dimethoxy-2-nitro-benzyl)-[2-(3-fluorophenyl)ethyl]ammonium Formula: C17H20FN2O4+ MolecularWeight: 335.350103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C[NH2+]CCC2=CC(=CC=C2)F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C[NH2+]CCC2=CC(=CC=C2)F)[N+](=O)[O-])OC

InChI

InChI=1S/C17H19FN2O4/c1-23-16-9-13(15(20(21)22)10-17(16)24-2)11-19-7-6-12-4-3-5-14(18)8-12/h3-5,8-10,19H,6-7,11H2,1-2H3/p+1