[4-[[4-azanyl-3-(trifluoromethyl)phenyl]amino]-4-oxidanylidene-butyl]-dimethyl-azanium

Systemtic Name: [4-[[4-azanyl-3-(trifluoromethyl)phenyl]amino]-4-oxidanylidene-butyl]-dimethyl-azanium Openeye Name: [4-[4-amino-3-(trifluoromethyl)anilino]-4-oxo-butyl]-dimethyl-ammonium CAS Name: [4-[4-amino-3-(trifluoromethyl)anilino]-4-oxobutyl]-dimethylammonium IUPAC Name: [4-[4-amino-3-(trifluoromethyl)anilino]-4-oxobutyl]-dimethylazanium Traditional Name: [4-[4-amino-3-(trifluoromethyl)anilino]-4-keto-butyl]-dimethyl-ammonium Formula: C13H19F3N3O+ MolecularWeight: 290.30467

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18F3N3O/c1-19(2)7-3-4-12(20)18-9-5-6-11(17)10(8-9)13(14,15)16/h5-6,8H,3-4,7,17H2,1-2H3,(H,18,20)/p+1