N,N-diethyl-1-octyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N,N-diethyl-1-octyl-pyridin-1-ium-3-carboxamide Openeye Name: N,N-diethyl-1-octyl-pyridin-1-ium-3-carboxamide CAS Name: N,N-diethyl-1-octyl-3-pyridin-1-iumcarboxamide IUPAC Name: N,N-diethyl-1-octylpyridin-1-ium-3-carboxamide Traditional Name: N,N-diethyl-1-octyl-pyridin-1-ium-3-carboxamide Formula: C18H31N2O+ MolecularWeight: 291.45154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+]1=CC=CC(=C1)C(=O)N(CC)CC

Isomeric SMILES

CCCCCCCC[N+]1=CC=CC(=C1)C(=O)N(CC)CC

InChI

InChI=1S/C18H31N2O/c1-4-7-8-9-10-11-14-19-15-12-13-17(16-19)18(21)20(5-2)6-3/h12-13,15-16H,4-11,14H2,1-3H3/q+1