3-(dimethylazaniumyl)propyl-[(3-fluorophenyl)methyl]-(furan-2-ylmethyl)azanium

Systemtic Name: 3-(dimethylazaniumyl)propyl-[(3-fluorophenyl)methyl]-(furan-2-ylmethyl)azanium Openeye Name: 3-(dimethylammonio)propyl-[(3-fluorophenyl)methyl]-(2-furylmethyl)ammonium CAS Name: 3-(dimethylammonio)propyl-[(3-fluorophenyl)methyl]-(2-furanylmethyl)ammonium IUPAC Name: 3-(dimethylazaniumyl)propyl-[(3-fluorophenyl)methyl]-(furan-2-ylmethyl)azanium Traditional Name: 3-(dimethylammonio)propyl-(3-fluorobenzyl)-(2-furfuryl)ammonium Formula: C17H25FN2O+2 MolecularWeight: 292.391603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[NH+](CC1=CC(=CC=C1)F)CC2=CC=CO2

Isomeric SMILES

C[NH+](C)CCC[NH+](CC1=CC(=CC=C1)F)CC2=CC=CO2

InChI

InChI=1S/C17H23FN2O/c1-19(2)9-5-10-20(14-17-8-4-11-21-17)13-15-6-3-7-16(18)12-15/h3-4,6-8,11-12H,5,9-10,13-14H2,1-2H3/p+2