5-[1-[(5-chloranyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]piperidin-4-yl]-2-phenyl-2-propan-2-yl-pentanenitrile

Systemtic Name: 5-[1-[(5-chloranyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]piperidin-4-yl]-2-phenyl-2-propan-2-yl-pentanenitrile Openeye Name: 5-[1-[(5-chloro-2-oxo-1H-pyridin-3-yl)methyl]-4-piperidyl]-2-isopropyl-2-phenyl-pentanenitrile CAS Name: 5-[1-[(5-chloro-2-oxo-1H-pyridin-3-yl)methyl]-4-piperidinyl]-2-phenyl-2-propan-2-ylpentanenitrile IUPAC Name: 5-[1-[(5-chloro-2-oxo-1H-pyridin-3-yl)methyl]piperidin-4-yl]-2-phenyl-2-propan-2-ylpentanenitrile Traditional Name: 5-[1-[(5-chloro-2-keto-1H-pyridin-3-yl)methyl]-4-piperidyl]-2-isopropyl-2-phenyl-valeronitrile Formula: C25H32ClN3O MolecularWeight: 425.99408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCC1CCN(CC1)CC2=CC(=CNC2=O)Cl)(C#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(CCCC1CCN(CC1)CC2=CC(=CNC2=O)Cl)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C25H32ClN3O/c1-19(2)25(18-27,22-8-4-3-5-9-22)12-6-7-20-10-13-29(14-11-20)17-21-15-23(26)16-28-24(21)30/h3-5,8-9,15-16,19-20H,6-7,10-14,17H2,1-2H3,(H,28,30)