N-(furan-2-ylmethyl)-2-isoquinolin-2-ium-2-yl-ethanamide chloride

Systemtic Name: N-(furan-2-ylmethyl)-2-isoquinolin-2-ium-2-yl-ethanamide chloride Openeye Name: N-(2-furylmethyl)-2-isoquinolin-2-ium-2-yl-acetamide chloride CAS Name: N-(2-furanylmethyl)-2-(2-isoquinolin-2-iumyl)acetamide chloride IUPAC Name: N-(furan-2-ylmethyl)-2-isoquinolin-2-ium-2-ylacetamide chloride Traditional Name: N-(2-furfuryl)-2-isoquinolin-2-ium-2-yl-acetamide chloride Formula: C16H15ClN2O2 MolecularWeight: 302.7555

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)NCC3=CC=CO3.[Cl-]

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)NCC3=CC=CO3.[Cl-]

InChI

InChI=1S/C16H14N2O2.ClH/c19-16(17-10-15-6-3-9-20-15)12-18-8-7-13-4-1-2-5-14(13)11-18;/h1-9,11H,10,12H2;1H