5-(methoxymethyl)-3-phenyl-2-(phenylmethyl)pyrazolo[1,5-a]pyrimidin-7-olate

Systemtic Name: 5-(methoxymethyl)-3-phenyl-2-(phenylmethyl)pyrazolo[1,5-a]pyrimidin-7-olate Openeye Name: 2-benzyl-5-(methoxymethyl)-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-olate CAS Name: 5-(methoxymethyl)-3-phenyl-2-(phenylmethyl)-7-pyrazolo[1,5-a]pyrimidinolate IUPAC Name: 2-benzyl-5-(methoxymethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7-olate Traditional Name: 2-benzyl-5-(methoxymethyl)-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-olate Formula: C21H18N3O2- MolecularWeight: 344.38652

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NC2=C(C(=NN2C(=C1)[O-])CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COCC1=NC2=C(C(=NN2C(=C1)[O-])CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3O2/c1-26-14-17-13-19(25)24-21(22-17)20(16-10-6-3-7-11-16)18(23-24)12-15-8-4-2-5-9-15/h2-11,13,25H,12,14H2,1H3/p-1