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

Systemtic Name: [2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(4-dimethylaminophenyl)methyl]-ethyl-azanium Openeye Name: [2-(4-bromo-2-fluoro-anilino)-2-oxo-ethyl]-[(4-dimethylaminophenyl)methyl]-ethyl-ammonium CAS Name: [2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-[(4-dimethylaminophenyl)methyl]-ethylammonium IUPAC Name: [2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-[(4-dimethylaminophenyl)methyl]-ethylazanium Traditional Name: [2-(4-bromo-2-fluoro-anilino)-2-keto-ethyl]-[4-(dimethylamino)benzyl]-ethyl-ammonium Formula: C19H24BrFN3O+ MolecularWeight: 409.315763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23BrFN3O/c1-4-24(12-14-5-8-16(9-6-14)23(2)3)13-19(25)22-18-10-7-15(20)11-17(18)21/h5-11H,4,12-13H2,1-3H3,(H,22,25)/p+1