6-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-1,3-dimethyl-pyrazolo[3,4-c]pyridin-7-one

Systemtic Name: 6-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-1,3-dimethyl-pyrazolo[3,4-c]pyridin-7-one Openeye Name: 6-[2-(azepan-1-yl)-2-oxo-ethyl]-1,3-dimethyl-pyrazolo[3,4-c]pyridin-7-one CAS Name: 6-[2-(1-azepanyl)-2-oxoethyl]-1,3-dimethyl-7-pyrazolo[3,4-c]pyridinone IUPAC Name: 6-[2-(azepan-1-yl)-2-oxoethyl]-1,3-dimethylpyrazolo[3,4-c]pyridin-7-one Traditional Name: 6-[2-(azepan-1-yl)-2-keto-ethyl]-1,3-dimethyl-pyrazolo[3,4-c]pyridin-7-one Formula: C16H22N4O2 MolecularWeight: 302.37148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=CN(C2=O)CC(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=NN(C2=C1C=CN(C2=O)CC(=O)N3CCCCCC3)C

InChI

InChI=1S/C16H22N4O2/c1-12-13-7-10-20(16(22)15(13)18(2)17-12)11-14(21)19-8-5-3-4-6-9-19/h7,10H,3-6,8-9,11H2,1-2H3