4,6-dimethyl-1,3-diphenyl-pyrimidin-1-ium-2-one perchlorate

Systemtic Name: 4,6-dimethyl-1,3-diphenyl-pyrimidin-1-ium-2-one perchlorate Openeye Name: 4,6-dimethyl-1,3-diphenyl-pyrimidin-1-ium-2-one perchlorate CAS Name: 4,6-dimethyl-1,3-diphenyl-2-pyrimidin-1-iumone perchlorate IUPAC Name: 4,6-dimethyl-1,3-diphenylpyrimidin-1-ium-2-one perchlorate Traditional Name: 4,6-dimethyl-1,3-diphenyl-pyrimidin-1-ium-2-one perchlorate Formula: C18H17ClN2O5 MolecularWeight: 376.79098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C(=O)N1C2=CC=CC=C2)C3=CC=CC=C3)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=[N+](C(=O)N1C2=CC=CC=C2)C3=CC=CC=C3)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C18H17N2O.ClHO4/c1-14-13-15(2)20(17-11-7-4-8-12-17)18(21)19(14)16-9-5-3-6-10-16;2-1(3,4)5/h3-13H,1-2H3;(H,2,3,4,5)/q+1;/p-1