1-(3-aminocarbonylpyridin-1-ium-1-yl)ethyl benzoate chloride

Systemtic Name: 1-(3-aminocarbonylpyridin-1-ium-1-yl)ethyl benzoate chloride Openeye Name: 1-(3-carbamoylpyridin-1-ium-1-yl)ethyl benzoate chloride CAS Name: benzoic acid 1-(3-carbamoyl-1-pyridin-1-iumyl)ethyl ester chloride IUPAC Name: 1-(3-carbamoylpyridin-1-ium-1-yl)ethyl benzoate chloride Traditional Name: benzoic acid 1-(3-carbamoylpyridin-1-ium-1-yl)ethyl ester chloride Formula: C15H15ClN2O3 MolecularWeight: 306.7442

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Descriptors Computed from Structure

Canonical SMILES:

CC([N+]1=CC=CC(=C1)C(=O)N)OC(=O)C2=CC=CC=C2.[Cl-]

Isomeric SMILES

CC([N+]1=CC=CC(=C1)C(=O)N)OC(=O)C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C15H14N2O3.ClH/c1-11(17-9-5-8-13(10-17)14(16)18)20-15(19)12-6-3-2-4-7-12;/h2-11H,1H3,(H-,16,18);1H