ethyl 4-(2-butylphenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 4-(2-butylphenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 4-(2-butylphenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 4-(2-butylphenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-butylphenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 4-(2-butylphenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C22H29N3O2 MolecularWeight: 367.48456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC=C1C2C3=CNNC3=NC(=C2C(=O)OCC)CCC

Isomeric SMILES

CCCCC1=CC=CC=C1C2C3=CNNC3=NC(=C2C(=O)OCC)CCC

InChI

InChI=1S/C22H29N3O2/c1-4-7-11-15-12-8-9-13-16(15)19-17-14-23-25-21(17)24-18(10-5-2)20(19)22(26)27-6-3/h8-9,12-14,19H,4-7,10-11H2,1-3H3,(H2,23,24,25)