(7-oxidanylidene-1-phenyl-pyrazolo[1,5-a]pyrimidin-5-yl)methyl-triphenyl-phosphanium

Systemtic Name: (7-oxidanylidene-1-phenyl-pyrazolo[1,5-a]pyrimidin-5-yl)methyl-triphenyl-phosphanium Openeye Name: (7-oxo-1-phenyl-pyrazolo[1,5-a]pyrimidin-5-yl)methyl-triphenyl-phosphonium CAS Name: (7-oxo-1-phenyl-5-pyrazolo[1,5-a]pyrimidinyl)methyl-triphenylphosphonium IUPAC Name: (7-oxo-1-phenylpyrazolo[1,5-a]pyrimidin-5-yl)methyl-triphenylphosphanium Traditional Name: (7-keto-1-phenyl-pyrazolo[1,5-a]pyrimidin-5-yl)methyl-triphenyl-phosphonium Formula: C31H25N3OP+ MolecularWeight: 486.523461

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=CC3=NC(=CC(=O)N32)C[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)N2C=CC3=NC(=CC(=O)N32)C[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H25N3OP/c35-31-23-25(32-30-21-22-33(34(30)31)26-13-5-1-6-14-26)24-36(27-15-7-2-8-16-27,28-17-9-3-10-18-28)29-19-11-4-12-20-29/h1-23H,24H2/q+1