2-methyl-4-(2-methylpiperidin-1-ium-1-yl)-[1]benzofuro[3,2-d]pyrimidine chloride

Systemtic Name: 2-methyl-4-(2-methylpiperidin-1-ium-1-yl)-[1]benzofuro[3,2-d]pyrimidine chloride Openeye Name: 2-methyl-4-(2-methylpiperidin-1-ium-1-yl)benzofuro[3,2-d]pyrimidine chloride CAS Name: 2-methyl-4-(2-methyl-1-piperidin-1-iumyl)benzofuro[3,2-d]pyrimidine chloride IUPAC Name: 2-methyl-4-(2-methylpiperidin-1-ium-1-yl)-[1]benzofuro[3,2-d]pyrimidine chloride Traditional Name: 2-methyl-4-(2-methylpiperidin-1-ium-1-yl)benzofuro[3,2-d]pyrimidine chloride Formula: C17H20ClN3O MolecularWeight: 317.8132

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1C2=NC(=NC3=C2OC4=CC=CC=C43)C.[Cl-]

Isomeric SMILES

CC1CCCC[NH+]1C2=NC(=NC3=C2OC4=CC=CC=C43)C.[Cl-]

InChI

InChI=1S/C17H19N3O.ClH/c1-11-7-5-6-10-20(11)17-16-15(18-12(2)19-17)13-8-3-4-9-14(13)21-16;/h3-4,8-9,11H,5-7,10H2,1-2H3;1H