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

Systemtic Name: 5-(methoxymethyl)-3-(4-methoxyphenyl)-2-(phenylmethyl)pyrazolo[1,5-a]pyrimidin-7-olate Openeye Name: 2-benzyl-5-(methoxymethyl)-3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-7-olate CAS Name: 5-(methoxymethyl)-3-(4-methoxyphenyl)-2-(phenylmethyl)-7-pyrazolo[1,5-a]pyrimidinolate IUPAC Name: 2-benzyl-5-(methoxymethyl)-3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-7-olate Traditional Name: 2-benzyl-5-(methoxymethyl)-3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-7-olate Formula: C22H20N3O3- MolecularWeight: 374.4125

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O3/c1-27-14-17-13-20(26)25-22(23-17)21(16-8-10-18(28-2)11-9-16)19(24-25)12-15-6-4-3-5-7-15/h3-11,13,26H,12,14H2,1-2H3/p-1