[2-[(3-azanyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium

Systemtic Name: [2-[(3-azanyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium Openeye Name: [2-(3-amino-4-fluoro-anilino)-2-oxo-ethyl]-benzyl-methyl-ammonium CAS Name: [2-(3-amino-4-fluoroanilino)-2-oxoethyl]-methyl-(phenylmethyl)ammonium IUPAC Name: [2-(3-amino-4-fluoroanilino)-2-oxoethyl]-benzyl-methylazanium Traditional Name: [2-(3-amino-4-fluoro-anilino)-2-keto-ethyl]-benzyl-methyl-ammonium Formula: C16H19FN3O+ MolecularWeight: 288.339963

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC(=C(C=C2)F)N

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC(=C(C=C2)F)N

InChI

InChI=1S/C16H18FN3O/c1-20(10-12-5-3-2-4-6-12)11-16(21)19-13-7-8-14(17)15(18)9-13/h2-9H,10-11,18H2,1H3,(H,19,21)/p+1