1-methyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-one; phosphoric acid

Systemtic Name: 1-methyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-one; phosphoric acid Openeye Name: 1-methyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-one; phosphoric acid CAS Name: 1-methyl-5-phenyl-7-pyrazolo[1,5-a]pyrimidinone; phosphoric acid IUPAC Name: 1-methyl-5-phenylpyrazolo[1,5-a]pyrimidin-7-one; phosphoric acid Traditional Name: 1-methyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-one; phosphoric acid Formula: C13H14N3O5P MolecularWeight: 323.241121

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=NC(=CC(=O)N21)C3=CC=CC=C3.OP(=O)(O)O

Isomeric SMILES

CN1C=CC2=NC(=CC(=O)N21)C3=CC=CC=C3.OP(=O)(O)O

InChI

InChI=1S/C13H11N3O.H3O4P/c1-15-8-7-12-14-11(9-13(17)16(12)15)10-5-3-2-4-6-10;1-5(2,3)4/h2-9H,1H3;(H3,1,2,3,4)