(2-methyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)-triphenyl-phosphanium perchlorate

Systemtic Name: (2-methyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)-triphenyl-phosphanium perchlorate Openeye Name: (4-hydroxy-2-methyl-6-oxo-1H-pyrimidin-5-yl)-triphenyl-phosphonium perchlorate CAS Name: (4-hydroxy-2-methyl-6-oxo-1H-pyrimidin-5-yl)-triphenylphosphonium perchlorate IUPAC Name: (4-hydroxy-2-methyl-6-oxo-1H-pyrimidin-5-yl)-triphenylphosphanium perchlorate Traditional Name: (4-hydroxy-6-keto-2-methyl-1H-pyrimidin-5-yl)-triphenyl-phosphonium perchlorate Formula: C23H20ClN2O6P MolecularWeight: 486.841461

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=O)N1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=NC(=C(C(=O)N1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C23H19N2O2P.ClHO4/c1-17-24-22(26)21(23(27)25-17)28(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20;2-1(3,4)5/h2-16H,1H3,(H-,24,25,26,27);(H,2,3,4,5)