(2-fluorophenyl)methyl-methyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (2-fluorophenyl)methyl-methyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (2-fluorophenyl)methyl-methyl-[2-(4-nitroanilino)-2-oxo-ethyl]ammonium CAS Name: (2-fluorophenyl)methyl-methyl-[2-(4-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: (2-fluorophenyl)methyl-methyl-[2-(4-nitroanilino)-2-oxoethyl]azanium Traditional Name: (2-fluorobenzyl)-[2-keto-2-(4-nitroanilino)ethyl]-methyl-ammonium Formula: C16H17FN3O3+ MolecularWeight: 318.322883

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1F)CC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[NH+](CC1=CC=CC=C1F)CC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H16FN3O3/c1-19(10-12-4-2-3-5-15(12)17)11-16(21)18-13-6-8-14(9-7-13)20(22)23/h2-9H,10-11H2,1H3,(H,18,21)/p+1