3-[(4-cyano-2-fluoranyl-phenyl)methylazaniumyl]propyl-diethyl-azanium

Systemtic Name: 3-[(4-cyano-2-fluoranyl-phenyl)methylazaniumyl]propyl-diethyl-azanium Openeye Name: 3-[(4-cyano-2-fluoro-phenyl)methylammonio]propyl-diethyl-ammonium CAS Name: 3-[(4-cyano-2-fluorophenyl)methylammonio]propyl-diethylammonium IUPAC Name: 3-[(4-cyano-2-fluorophenyl)methylazaniumyl]propyl-diethylazanium Traditional Name: 3-[(4-cyano-2-fluoro-benzyl)ammonio]propyl-diethyl-ammonium Formula: C15H24FN3+2 MolecularWeight: 265.369563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC[NH2+]CC1=C(C=C(C=C1)C#N)F

Isomeric SMILES

CC[NH+](CC)CCC[NH2+]CC1=C(C=C(C=C1)C#N)F

InChI

InChI=1S/C15H22FN3/c1-3-19(4-2)9-5-8-18-12-14-7-6-13(11-17)10-15(14)16/h6-7,10,18H,3-5,8-9,12H2,1-2H3/p+2