[4-[(5-azanyl-2-fluoranyl-phenyl)amino]-4-oxidanylidene-butyl]-dimethyl-azanium

Systemtic Name: [4-[(5-azanyl-2-fluoranyl-phenyl)amino]-4-oxidanylidene-butyl]-dimethyl-azanium Openeye Name: [4-(5-amino-2-fluoro-anilino)-4-oxo-butyl]-dimethyl-ammonium CAS Name: [4-(5-amino-2-fluoroanilino)-4-oxobutyl]-dimethylammonium IUPAC Name: [4-(5-amino-2-fluoroanilino)-4-oxobutyl]-dimethylazanium Traditional Name: [4-(5-amino-2-fluoro-anilino)-4-keto-butyl]-dimethyl-ammonium Formula: C12H19FN3O+ MolecularWeight: 240.297163

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCC(=O)NC1=C(C=CC(=C1)N)F

Isomeric SMILES

C[NH+](C)CCCC(=O)NC1=C(C=CC(=C1)N)F

InChI

InChI=1S/C12H18FN3O/c1-16(2)7-3-4-12(17)15-11-8-9(14)5-6-10(11)13/h5-6,8H,3-4,7,14H2,1-2H3,(H,15,17)/p+1