N-(2-chloranyl-6-methyl-phenyl)-2-pyrrolidin-1-ium-1-yl-ethanamide bromide

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-2-pyrrolidin-1-ium-1-yl-ethanamide bromide Openeye Name: N-(2-chloro-6-methyl-phenyl)-2-pyrrolidin-1-ium-1-yl-acetamide bromide CAS Name: N-(2-chloro-6-methylphenyl)-2-(1-pyrrolidin-1-iumyl)acetamide bromide IUPAC Name: N-(2-chloro-6-methylphenyl)-2-pyrrolidin-1-ium-1-ylacetamide bromide Traditional Name: N-(2-chloro-6-methyl-phenyl)-2-pyrrolidin-1-ium-1-yl-acetamide bromide Formula: C13H18BrClN2O MolecularWeight: 333.65182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)NC(=O)C[NH+]2CCCC2.[Br-]

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC(=O)C[NH+]2CCCC2.[Br-]

InChI

InChI=1S/C13H17ClN2O.BrH/c1-10-5-4-6-11(14)13(10)15-12(17)9-16-7-2-3-8-16;/h4-6H,2-3,7-9H2,1H3,(H,15,17);1H