2-(3-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl)-2-propan-2-yl-hept-6-enoic acid

Systemtic Name: 2-(3-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl)-2-propan-2-yl-hept-6-enoic acid Openeye Name: 2-isopropyl-2-(3-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl)hept-6-enoic acid CAS Name: 2-(3-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl)-2-propan-2-yl-6-heptenoic acid IUPAC Name: 2-(3-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl)-2-propan-2-ylhept-6-enoic acid Traditional Name: 2-isopropyl-2-(3-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl)hept-6-enoic acid Formula: C22H25N3O2 MolecularWeight: 363.4528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCC=C)(C1=CC2=C(NN=C2N=C1)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)C(CCCC=C)(C1=CC2=C(NN=C2N=C1)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H25N3O2/c1-4-5-9-12-22(15(2)3,21(26)27)17-13-18-19(16-10-7-6-8-11-16)24-25-20(18)23-14-17/h4,6-8,10-11,13-15H,1,5,9,12H2,2-3H3,(H,26,27)(H,23,24,25)