1-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxamide chloride

Systemtic Name: 1-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxamide chloride Openeye Name: 1-[2-(2-furylmethylamino)-2-oxo-ethyl]pyridin-1-ium-3-carboxamide chloride CAS Name: 1-[2-(2-furanylmethylamino)-2-oxoethyl]-3-pyridin-1-iumcarboxamide chloride IUPAC Name: 1-[2-(furan-2-ylmethylamino)-2-oxoethyl]pyridin-1-ium-3-carboxamide chloride Traditional Name: 1-[2-(2-furfurylamino)-2-keto-ethyl]pyridin-1-ium-3-carboxamide chloride Formula: C13H14ClN3O3 MolecularWeight: 295.72156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)CC(=O)NCC2=CC=CO2)C(=O)N.[Cl-]

Isomeric SMILES

C1=CC(=C[N+](=C1)CC(=O)NCC2=CC=CO2)C(=O)N.[Cl-]

InChI

InChI=1S/C13H13N3O3.ClH/c14-13(18)10-3-1-5-16(8-10)9-12(17)15-7-11-4-2-6-19-11;/h1-6,8H,7,9H2,(H2-,14,15,17,18);1H