3-[[2-[(3-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethanoyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[2-[(3-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethanoyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[2-(3-fluoro-4-methyl-anilino)-2-oxo-acetyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[2-(3-fluoro-4-methylanilino)-1,2-dioxoethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[2-(3-fluoro-4-methylanilino)-2-oxoacetyl]amino]propyl-dimethylazanium Traditional Name: 3-[[2-(3-fluoro-4-methyl-anilino)-2-keto-acetyl]amino]propyl-dimethyl-ammonium Formula: C14H21FN3O2+ MolecularWeight: 282.333843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(=O)NCCC[NH+](C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(=O)NCCC[NH+](C)C)F

InChI

InChI=1S/C14H20FN3O2/c1-10-5-6-11(9-12(10)15)17-14(20)13(19)16-7-4-8-18(2)3/h5-6,9H,4,7-8H2,1-3H3,(H,16,19)(H,17,20)/p+1