(2-chloranyl-6-fluoranyl-phenyl)methyl-bis[3-(dimethylazaniumyl)propyl]azanium

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl-bis[3-(dimethylazaniumyl)propyl]azanium Openeye Name: (2-chloro-6-fluoro-phenyl)methyl-bis[3-(dimethylammonio)propyl]ammonium CAS Name: (2-chloro-6-fluorophenyl)methyl-bis[3-(dimethylammonio)propyl]ammonium IUPAC Name: (2-chloro-6-fluorophenyl)methyl-bis[3-(dimethylazaniumyl)propyl]azanium Traditional Name: (2-chloro-6-fluoro-benzyl)-bis[3-(dimethylammonio)propyl]ammonium Formula: C17H32ClFN3+3 MolecularWeight: 332.907483

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[NH+](CCC[NH+](C)C)CC1=C(C=CC=C1Cl)F

Isomeric SMILES

C[NH+](C)CCC[NH+](CCC[NH+](C)C)CC1=C(C=CC=C1Cl)F

InChI

InChI=1S/C17H29ClFN3/c1-20(2)10-6-12-22(13-7-11-21(3)4)14-15-16(18)8-5-9-17(15)19/h5,8-9H,6-7,10-14H2,1-4H3/p+3