(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl-methyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl-methyl-[2-(4-nitroanilino)-2-oxo-ethyl]ammonium CAS Name: (3-fluoro-4-methoxyphenyl)methyl-methyl-[2-(4-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl-methyl-[2-(4-nitroanilino)-2-oxoethyl]azanium Traditional Name: (3-fluoro-4-methoxy-benzyl)-[2-keto-2-(4-nitroanilino)ethyl]-methyl-ammonium Formula: C17H19FN3O4+ MolecularWeight: 348.348863

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18FN3O4/c1-20(10-12-3-8-16(25-2)15(18)9-12)11-17(22)19-13-4-6-14(7-5-13)21(23)24/h3-9H,10-11H2,1-2H3,(H,19,22)/p+1