N-(4-bromanyl-2-methyl-phenyl)-2-[methyl-[5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[methyl-[5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[methyl-[5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[methyl-[5-(trifluoromethyl)-2-pyridin-1-iumyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[methyl-[5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[methyl-[5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]acetamide Formula: C16H16BrF3N3O+ MolecularWeight: 403.21695

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15BrF3N3O/c1-10-7-12(17)4-5-13(10)22-15(24)9-23(2)14-6-3-11(8-21-14)16(18,19)20/h3-8H,9H2,1-2H3,(H,22,24)/p+1