3,3-dimethyl-4-[6-oxidanylidene-1-(pyridin-2-ylmethyl)piperidin-3-yl]carbonyl-piperazin-2-one

Systemtic Name: 3,3-dimethyl-4-[6-oxidanylidene-1-(pyridin-2-ylmethyl)piperidin-3-yl]carbonyl-piperazin-2-one Openeye Name: 3,3-dimethyl-4-[6-oxo-1-(2-pyridylmethyl)piperidine-3-carbonyl]piperazin-2-one CAS Name: 3,3-dimethyl-4-[oxo-[6-oxo-1-(2-pyridinylmethyl)-3-piperidinyl]methyl]-2-piperazinone IUPAC Name: 3,3-dimethyl-4-[6-oxo-1-(pyridin-2-ylmethyl)piperidine-3-carbonyl]piperazin-2-one Traditional Name: 4-[6-keto-1-(2-pyridylmethyl)nipecotoyl]-3,3-dimethyl-piperazin-2-one Formula: C18H24N4O3 MolecularWeight: 344.40816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NCCN1C(=O)C2CCC(=O)N(C2)CC3=CC=CC=N3)C

Isomeric SMILES

CC1(C(=O)NCCN1C(=O)C2CCC(=O)N(C2)CC3=CC=CC=N3)C

InChI

InChI=1S/C18H24N4O3/c1-18(2)17(25)20-9-10-22(18)16(24)13-6-7-15(23)21(11-13)12-14-5-3-4-8-19-14/h3-5,8,13H,6-7,9-12H2,1-2H3,(H,20,25)