3-ethoxypropyl-(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)azanium chloride

Systemtic Name: 3-ethoxypropyl-(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)azanium chloride Openeye Name: 3-ethoxypropyl-(2-methylbenzofuro[3,2-d]pyrimidin-4-yl)ammonium chloride CAS Name: 3-ethoxypropyl-(2-methyl-4-benzofuro[3,2-d]pyrimidinyl)ammonium chloride IUPAC Name: 3-ethoxypropyl-(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)azanium chloride Traditional Name: 3-ethoxypropyl-(2-methylbenzofuro[3,2-d]pyrimidin-4-yl)ammonium chloride Formula: C16H20ClN3O2 MolecularWeight: 321.8019

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCC[NH2+]C1=NC(=NC2=C1OC3=CC=CC=C32)C.[Cl-]

Isomeric SMILES

CCOCCC[NH2+]C1=NC(=NC2=C1OC3=CC=CC=C32)C.[Cl-]

InChI

InChI=1S/C16H19N3O2.ClH/c1-3-20-10-6-9-17-16-15-14(18-11(2)19-16)12-7-4-5-8-13(12)21-15;/h4-5,7-8H,3,6,9-10H2,1-2H3,(H,17,18,19);1H