3-(4-methoxyphenyl)-2,5-dimethyl-6-(phenylmethyl)pyrazolo[1,5-a]pyrimidin-7-olate

Systemtic Name: 3-(4-methoxyphenyl)-2,5-dimethyl-6-(phenylmethyl)pyrazolo[1,5-a]pyrimidin-7-olate Openeye Name: 6-benzyl-3-(4-methoxyphenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-olate CAS Name: 3-(4-methoxyphenyl)-2,5-dimethyl-6-(phenylmethyl)-7-pyrazolo[1,5-a]pyrimidinolate IUPAC Name: 6-benzyl-3-(4-methoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-olate Traditional Name: 6-benzyl-3-(4-methoxyphenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-olate Formula: C22H20N3O2- MolecularWeight: 358.4131

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C(=C1CC3=CC=CC=C3)[O-])C)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NC2=C(C(=NN2C(=C1CC3=CC=CC=C3)[O-])C)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H21N3O2/c1-14-19(13-16-7-5-4-6-8-16)22(26)25-21(23-14)20(15(2)24-25)17-9-11-18(27-3)12-10-17/h4-12,26H,13H2,1-3H3/p-1