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

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[4-(dimethylamino)-1-pyridin-1-iumyl]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide Formula: C16H19BrN3O+ MolecularWeight: 349.24556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C[N+]2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C[N+]2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C16H18BrN3O/c1-12-10-13(17)4-5-15(12)18-16(21)11-20-8-6-14(7-9-20)19(2)3/h4-10H,11H2,1-3H3/p+1