hexyl 2-(3-aminocarbonylpyridin-1-ium-1-yl)ethanoate chloride

Systemtic Name: hexyl 2-(3-aminocarbonylpyridin-1-ium-1-yl)ethanoate chloride Openeye Name: hexyl 2-(3-carbamoylpyridin-1-ium-1-yl)acetate chloride CAS Name: 2-(3-carbamoyl-1-pyridin-1-iumyl)acetic acid hexyl ester chloride IUPAC Name: hexyl 2-(3-carbamoylpyridin-1-ium-1-yl)acetate chloride Traditional Name: 2-(3-carbamoylpyridin-1-ium-1-yl)acetic acid hexyl ester chloride Formula: C14H21ClN2O3 MolecularWeight: 300.78114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O3.ClH/c1-2-3-4-5-9-19-13(17)11-16-8-6-7-12(10-16)14(15)18;/h6-8,10H,2-5,9,11H2,1H3,(H-,15,18);1H