3-[[5-(3-chloranyl-4-fluoranyl-phenyl)furan-2-yl]methylazaniumyl]propyl-diethyl-azanium

Systemtic Name: 3-[[5-(3-chloranyl-4-fluoranyl-phenyl)furan-2-yl]methylazaniumyl]propyl-diethyl-azanium Openeye Name: 3-[[5-(3-chloro-4-fluoro-phenyl)-2-furyl]methylammonio]propyl-diethyl-ammonium CAS Name: 3-[[5-(3-chloro-4-fluorophenyl)-2-furanyl]methylammonio]propyl-diethylammonium IUPAC Name: 3-[[5-(3-chloro-4-fluorophenyl)furan-2-yl]methylazaniumyl]propyl-diethylazanium Traditional Name: 3-[[5-(3-chloro-4-fluoro-phenyl)-2-furyl]methylammonio]propyl-diethyl-ammonium Formula: C18H26ClFN2O+2 MolecularWeight: 340.863243

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC[NH2+]CC1=CC=C(O1)C2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CC[NH+](CC)CCC[NH2+]CC1=CC=C(O1)C2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C18H24ClFN2O/c1-3-22(4-2)11-5-10-21-13-15-7-9-18(23-15)14-6-8-17(20)16(19)12-14/h6-9,12,21H,3-5,10-11,13H2,1-2H3/p+2