(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)methylphosphonic acid

Systemtic Name: (5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)methylphosphonic acid Openeye Name: (5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)methylphosphonic acid CAS Name: (5-phenyl-7-pyrazolo[1,5-a]pyrimidinyl)methylphosphonic acid IUPAC Name: (5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)methylphosphonic acid Traditional Name: (5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)methylphosphonic acid Formula: C13H12N3O3P MolecularWeight: 289.226441

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=NN3C(=C2)CP(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=NN3C(=C2)CP(=O)(O)O

InChI

InChI=1S/C13H12N3O3P/c17-20(18,19)9-11-8-12(10-4-2-1-3-5-10)15-13-6-7-14-16(11)13/h1-8H,9H2,(H2,17,18,19)