[9-[(4-methoxyphenyl)methyl]-2-methyl-purin-6-yl]-methyl-azanium chloride

Systemtic Name: [9-[(4-methoxyphenyl)methyl]-2-methyl-purin-6-yl]-methyl-azanium chloride Openeye Name: [9-[(4-methoxyphenyl)methyl]-2-methyl-purin-6-yl]-methyl-ammonium chloride CAS Name: [9-[(4-methoxyphenyl)methyl]-2-methyl-6-purinyl]-methylammonium chloride IUPAC Name: [9-[(4-methoxyphenyl)methyl]-2-methylpurin-6-yl]-methylazanium chloride Traditional Name: methyl-(2-methyl-9-p-anisyl-purin-6-yl)ammonium chloride Formula: C15H18ClN5O MolecularWeight: 319.78932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)[NH2+]C)N=CN2CC3=CC=C(C=C3)OC.[Cl-]

Isomeric SMILES

CC1=NC2=C(C(=N1)[NH2+]C)N=CN2CC3=CC=C(C=C3)OC.[Cl-]

InChI

InChI=1S/C15H17N5O.ClH/c1-10-18-14(16-2)13-15(19-10)20(9-17-13)8-11-4-6-12(21-3)7-5-11;/h4-7,9H,8H2,1-3H3,(H,16,18,19);1H