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

Systemtic Name: N,N-diethyl-1-hexyl-pyridin-1-ium-3-carboxamide Openeye Name: N,N-diethyl-1-hexyl-pyridin-1-ium-3-carboxamide CAS Name: N,N-diethyl-1-hexyl-3-pyridin-1-iumcarboxamide IUPAC Name: N,N-diethyl-1-hexylpyridin-1-ium-3-carboxamide Traditional Name: N,N-diethyl-1-hexyl-pyridin-1-ium-3-carboxamide Formula: C16H27N2O+ MolecularWeight: 263.39838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27N2O/c1-4-7-8-9-12-17-13-10-11-15(14-17)16(19)18(5-2)6-3/h10-11,13-14H,4-9,12H2,1-3H3/q+1