1,2-dimethyl-5-[(4-methylphenoxy)methyl]pyrimidin-1-ium-4-amine perchlorate

Systemtic Name: 1,2-dimethyl-5-[(4-methylphenoxy)methyl]pyrimidin-1-ium-4-amine perchlorate Openeye Name: 1,2-dimethyl-5-[(4-methylphenoxy)methyl]pyrimidin-1-ium-4-amine perchlorate CAS Name: 1,2-dimethyl-5-[(4-methylphenoxy)methyl]-4-pyrimidin-1-iumamine perchlorate IUPAC Name: 1,2-dimethyl-5-[(4-methylphenoxy)methyl]pyrimidin-1-ium-4-amine perchlorate Traditional Name: [1,2-dimethyl-5-[(4-methylphenoxy)methyl]pyrimidin-1-ium-4-yl]amine perchlorate Formula: C14H18ClN3O5 MolecularWeight: 343.76282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=C[N+](=C(N=C2N)C)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=C[N+](=C(N=C2N)C)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C14H17N3O.ClHO4/c1-10-4-6-13(7-5-10)18-9-12-8-17(3)11(2)16-14(12)15;2-1(3,4)5/h4-8,15H,9H2,1-3H3;(H,2,3,4,5)