[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-methylphenyl)methyl]azanium

Systemtic Name: [2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-methylphenyl)methyl]azanium Openeye Name: [2-(4-bromo-2-fluoro-anilino)-2-oxo-ethyl]-methyl-(p-tolylmethyl)ammonium CAS Name: [2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: [2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-methyl-[(4-methylphenyl)methyl]azanium Traditional Name: [2-(4-bromo-2-fluoro-anilino)-2-keto-ethyl]-methyl-(4-methylbenzyl)ammonium Formula: C17H19BrFN2O+ MolecularWeight: 366.247963

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18BrFN2O/c1-12-3-5-13(6-4-12)10-21(2)11-17(22)20-16-8-7-14(18)9-15(16)19/h3-9H,10-11H2,1-2H3,(H,20,22)/p+1