2-[(4-methoxyphenyl)methyl]-3,5-diphenyl-pyrazolo[1,5-a]pyrimidin-7-olate

Systemtic Name: 2-[(4-methoxyphenyl)methyl]-3,5-diphenyl-pyrazolo[1,5-a]pyrimidin-7-olate Openeye Name: 2-[(4-methoxyphenyl)methyl]-3,5-diphenyl-pyrazolo[1,5-a]pyrimidin-7-olate CAS Name: 2-[(4-methoxyphenyl)methyl]-3,5-diphenyl-7-pyrazolo[1,5-a]pyrimidinolate IUPAC Name: 2-[(4-methoxyphenyl)methyl]-3,5-diphenylpyrazolo[1,5-a]pyrimidin-7-olate Traditional Name: 2-p-anisyl-3,5-diphenyl-pyrazolo[1,5-a]pyrimidin-7-olate Formula: C26H20N3O2- MolecularWeight: 406.4559

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NN3C(=CC(=NC3=C2C4=CC=CC=C4)C5=CC=CC=C5)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NN3C(=CC(=NC3=C2C4=CC=CC=C4)C5=CC=CC=C5)[O-]

InChI

InChI=1S/C26H21N3O2/c1-31-21-14-12-18(13-15-21)16-23-25(20-10-6-3-7-11-20)26-27-22(17-24(30)29(26)28-23)19-8-4-2-5-9-19/h2-15,17,30H,16H2,1H3/p-1