[4-(azaniumylmethyl)-2-fluoranyl-phenyl]methyl-dipropyl-azanium

Systemtic Name: [4-(azaniumylmethyl)-2-fluoranyl-phenyl]methyl-dipropyl-azanium Openeye Name: [4-(azaniumylmethyl)-2-fluoro-phenyl]methyl-dipropyl-ammonium CAS Name: [4-(ammoniomethyl)-2-fluorophenyl]methyl-dipropylammonium IUPAC Name: [4-(azaniumylmethyl)-2-fluorophenyl]methyl-dipropylazanium Traditional Name: [4-(ammoniomethyl)-2-fluoro-benzyl]-dipropyl-ammonium Formula: C14H25FN2+2 MolecularWeight: 240.360103

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)CC1=C(C=C(C=C1)C[NH3+])F

Isomeric SMILES

CCC[NH+](CCC)CC1=C(C=C(C=C1)C[NH3+])F

InChI

InChI=1S/C14H23FN2/c1-3-7-17(8-4-2)11-13-6-5-12(10-16)9-14(13)15/h5-6,9H,3-4,7-8,10-11,16H2,1-2H3/p+2