1-[2-(dodecylamino)-2-oxidanylidene-ethyl]-N,N-diethyl-pyridin-1-ium-3-carboxamide chloride

Systemtic Name: 1-[2-(dodecylamino)-2-oxidanylidene-ethyl]-N,N-diethyl-pyridin-1-ium-3-carboxamide chloride Openeye Name: 1-[2-(dodecylamino)-2-oxo-ethyl]-N,N-diethyl-pyridin-1-ium-3-carboxamide chloride CAS Name: 1-[2-(dodecylamino)-2-oxoethyl]-N,N-diethyl-3-pyridin-1-iumcarboxamide chloride IUPAC Name: 1-[2-(dodecylamino)-2-oxoethyl]-N,N-diethylpyridin-1-ium-3-carboxamide chloride Traditional Name: N,N-diethyl-1-[2-keto-2-(laurylamino)ethyl]pyridin-1-ium-3-carboxamide chloride Formula: C24H42ClN3O2 MolecularWeight: 440.06218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H41N3O2.ClH/c1-4-7-8-9-10-11-12-13-14-15-18-25-23(28)21-26-19-16-17-22(20-26)24(29)27(5-2)6-3;/h16-17,19-20H,4-15,18,21H2,1-3H3;1H