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

Systemtic Name: N,N-diethyl-1-octyl-pyridin-1-ium-3-carboxamide chloride Openeye Name: N,N-diethyl-1-octyl-pyridin-1-ium-3-carboxamide chloride CAS Name: N,N-diethyl-1-octyl-3-pyridin-1-iumcarboxamide chloride IUPAC Name: N,N-diethyl-1-octylpyridin-1-ium-3-carboxamide chloride Traditional Name: N,N-diethyl-1-octyl-pyridin-1-ium-3-carboxamide chloride Formula: C18H31ClN2O MolecularWeight: 326.90454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H31N2O.ClH/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;1H/q+1;/p-1