[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(4-fluorophenyl)methyl]-methyl-azanium

Systemtic Name: [2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(4-fluorophenyl)methyl]-methyl-azanium Openeye Name: [2-(4-bromo-3-methyl-anilino)-2-oxo-ethyl]-[(4-fluorophenyl)methyl]-methyl-ammonium CAS Name: [2-(4-bromo-3-methylanilino)-2-oxoethyl]-[(4-fluorophenyl)methyl]-methylammonium IUPAC Name: [2-(4-bromo-3-methylanilino)-2-oxoethyl]-[(4-fluorophenyl)methyl]-methylazanium Traditional Name: [2-(4-bromo-3-methyl-anilino)-2-keto-ethyl]-(4-fluorobenzyl)-methyl-ammonium Formula: C17H19BrFN2O+ MolecularWeight: 366.247963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)F)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)F)Br

InChI

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