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

Systemtic Name: 2-[[5-(3-chloranyl-4-fluoranyl-phenyl)furan-2-yl]methylazaniumyl]ethyl-dimethyl-azanium Openeye Name: 2-[[5-(3-chloro-4-fluoro-phenyl)-2-furyl]methylammonio]ethyl-dimethyl-ammonium CAS Name: 2-[[5-(3-chloro-4-fluorophenyl)-2-furanyl]methylammonio]ethyl-dimethylammonium IUPAC Name: 2-[[5-(3-chloro-4-fluorophenyl)furan-2-yl]methylazaniumyl]ethyl-dimethylazanium Traditional Name: 2-[[5-(3-chloro-4-fluoro-phenyl)-2-furyl]methylammonio]ethyl-dimethyl-ammonium Formula: C15H20ClFN2O+2 MolecularWeight: 298.783503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18ClFN2O/c1-19(2)8-7-18-10-12-4-6-15(20-12)11-3-5-14(17)13(16)9-11/h3-6,9,18H,7-8,10H2,1-2H3/p+2