N-butyl-2-[4-(phenylmethyl)pyridin-1-ium-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-(phenylmethyl)pyridin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-butyl-acetamide CAS Name: N-butyl-2-[4-(phenylmethyl)-1-pyridin-1-iumyl]acetamide IUPAC Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-butylacetamide Traditional Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-butyl-acetamide Formula: C18H23N2O+ MolecularWeight: 283.38802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C[N+]1=CC=C(C=C1)CC2=CC=CC=C2

Isomeric SMILES

CCCCNC(=O)C[N+]1=CC=C(C=C1)CC2=CC=CC=C2

InChI

InChI=1S/C18H22N2O/c1-2-3-11-19-18(21)15-20-12-9-17(10-13-20)14-16-7-5-4-6-8-16/h4-10,12-13H,2-3,11,14-15H2,1H3/p+1