3-[5,7-diethyl-3-(4-hydroxyphenyl)pyrazolo[1,5-a]pyrimidin-2-yl]phenol

Systemtic Name: 3-[5,7-diethyl-3-(4-hydroxyphenyl)pyrazolo[1,5-a]pyrimidin-2-yl]phenol Openeye Name: 3-[5,7-diethyl-3-(4-hydroxyphenyl)pyrazolo[1,5-a]pyrimidin-2-yl]phenol CAS Name: 3-[5,7-diethyl-3-(4-hydroxyphenyl)-2-pyrazolo[1,5-a]pyrimidinyl]phenol IUPAC Name: 3-[5,7-diethyl-3-(4-hydroxyphenyl)pyrazolo[1,5-a]pyrimidin-2-yl]phenol Traditional Name: 3-[5,7-diethyl-3-(4-hydroxyphenyl)pyrazolo[1,5-a]pyrimidin-2-yl]phenol Formula: C22H21N3O2 MolecularWeight: 359.42104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC2=C(C(=NN12)C3=CC(=CC=C3)O)C4=CC=C(C=C4)O)CC

Isomeric SMILES

CCC1=CC(=NC2=C(C(=NN12)C3=CC(=CC=C3)O)C4=CC=C(C=C4)O)CC

InChI

InChI=1S/C22H21N3O2/c1-3-16-13-17(4-2)25-22(23-16)20(14-8-10-18(26)11-9-14)21(24-25)15-6-5-7-19(27)12-15/h5-13,26-27H,3-4H2,1-2H3