6-[2-(2-acetamidophenyl)ethyl]-N,N-diethyl-1-methyl-pyridin-1-ium-3-carboxamide

Systemtic Name: 6-[2-(2-acetamidophenyl)ethyl]-N,N-diethyl-1-methyl-pyridin-1-ium-3-carboxamide Openeye Name: 6-[2-(2-acetamidophenyl)ethyl]-N,N-diethyl-1-methyl-pyridin-1-ium-3-carboxamide CAS Name: 6-[2-(2-acetamidophenyl)ethyl]-N,N-diethyl-1-methyl-3-pyridin-1-iumcarboxamide IUPAC Name: 6-[2-(2-acetamidophenyl)ethyl]-N,N-diethyl-1-methylpyridin-1-ium-3-carboxamide Traditional Name: 6-[2-(2-acetamidophenyl)ethyl]-N,N-diethyl-1-methyl-pyridin-1-ium-3-carboxamide Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C[N+](=C(C=C1)CCC2=CC=CC=C2NC(=O)C)C

Isomeric SMILES

CCN(CC)C(=O)C1=C[N+](=C(C=C1)CCC2=CC=CC=C2NC(=O)C)C

InChI

InChI=1S/C21H27N3O2/c1-5-24(6-2)21(26)18-12-14-19(23(4)15-18)13-11-17-9-7-8-10-20(17)22-16(3)25/h7-10,12,14-15H,5-6,11,13H2,1-4H3/p+1