N-[2,6-bis(bromanyl)-4-methyl-phenyl]-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-methyl-phenyl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-(2,6-dibromo-4-methyl-phenyl)-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-(2,6-dibromo-4-methylphenyl)-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-(2,6-dibromo-4-methylphenyl)-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-(2,6-dibromo-4-methyl-phenyl)-2-piperidin-1-ium-1-yl-acetamide Formula: C14H19Br2N2O+ MolecularWeight: 391.12146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)NC(=O)C[NH+]2CCCCC2)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)NC(=O)C[NH+]2CCCCC2)Br

InChI

InChI=1S/C14H18Br2N2O/c1-10-7-11(15)14(12(16)8-10)17-13(19)9-18-5-3-2-4-6-18/h7-8H,2-6,9H2,1H3,(H,17,19)/p+1