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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24FN3O/c1-15(2,10-19(3)4)9-18-8-12-6-5-11(14(17)20)7-13(12)16/h5-7,18H,8-10H2,1-4H3,(H2,17,20)/p+2