[1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: [1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: [2-(azepan-1-yl)-1-methyl-2-oxo-ethyl] 1-isopropylpyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxylic acid [1-(1-azepanyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(azepan-1-yl)-1-oxopropan-2-yl] 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-isopropylpyrazolo[3,4-b]pyridine-5-carboxylic acid [2-(azepan-1-yl)-2-keto-1-methyl-ethyl] ester Formula: C19H26N4O3 MolecularWeight: 358.43474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)OC(C)C(=O)N3CCCCCC3

Isomeric SMILES

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)OC(C)C(=O)N3CCCCCC3

InChI

InChI=1S/C19H26N4O3/c1-13(2)23-17-15(12-21-23)10-16(11-20-17)19(25)26-14(3)18(24)22-8-6-4-5-7-9-22/h10-14H,4-9H2,1-3H3