3-[(4-aminocarbonyl-2-fluoranyl-phenyl)methylazaniumyl]propyl-diethyl-azanium

Systemtic Name: 3-[(4-aminocarbonyl-2-fluoranyl-phenyl)methylazaniumyl]propyl-diethyl-azanium Openeye Name: 3-[(4-carbamoyl-2-fluoro-phenyl)methylammonio]propyl-diethyl-ammonium CAS Name: 3-[(4-carbamoyl-2-fluorophenyl)methylammonio]propyl-diethylammonium IUPAC Name: 3-[(4-carbamoyl-2-fluorophenyl)methylazaniumyl]propyl-diethylazanium Traditional Name: 3-[(4-carbamoyl-2-fluoro-benzyl)ammonio]propyl-diethyl-ammonium Formula: C15H26FN3O+2 MolecularWeight: 283.384843

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC[NH2+]CC1=C(C=C(C=C1)C(=O)N)F

Isomeric SMILES

CC[NH+](CC)CCC[NH2+]CC1=C(C=C(C=C1)C(=O)N)F

InChI

InChI=1S/C15H24FN3O/c1-3-19(4-2)9-5-8-18-11-13-7-6-12(15(17)20)10-14(13)16/h6-7,10,18H,3-5,8-9,11H2,1-2H3,(H2,17,20)/p+2