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

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-propyl-azanium Openeye Name: (4-bromo-2-fluoro-phenyl)methyl-[2-(2-methylanilino)-2-oxo-ethyl]-propyl-ammonium CAS Name: (4-bromo-2-fluorophenyl)methyl-[2-(2-methylanilino)-2-oxoethyl]-propylammonium IUPAC Name: (4-bromo-2-fluorophenyl)methyl-[2-(2-methylanilino)-2-oxoethyl]-propylazanium Traditional Name: (4-bromo-2-fluoro-benzyl)-[2-keto-2-(o-toluidino)ethyl]-propyl-ammonium Formula: C19H23BrFN2O+ MolecularWeight: 394.301123

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1=C(C=C(C=C1)Br)F)CC(=O)NC2=CC=CC=C2C

Isomeric SMILES

CCC[NH+](CC1=C(C=C(C=C1)Br)F)CC(=O)NC2=CC=CC=C2C

InChI

InChI=1S/C19H22BrFN2O/c1-3-10-23(12-15-8-9-16(20)11-17(15)21)13-19(24)22-18-7-5-4-6-14(18)2/h4-9,11H,3,10,12-13H2,1-2H3,(H,22,24)/p+1