N-(cyanomethyl)-4-methyl-2-[3-[4-(4-oxidanylpiperidin-4-yl)phenyl]phenyl]pentanamide

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(4-oxidanylpiperidin-4-yl)phenyl]phenyl]pentanamide Openeye Name: N-(cyanomethyl)-2-[3-[4-(4-hydroxy-4-piperidyl)phenyl]phenyl]-4-methyl-pentanamide CAS Name: N-(cyanomethyl)-2-[3-[4-(4-hydroxy-4-piperidinyl)phenyl]phenyl]-4-methylpentanamide IUPAC Name: N-(cyanomethyl)-2-[3-[4-(4-hydroxypiperidin-4-yl)phenyl]phenyl]-4-methylpentanamide Traditional Name: N-(cyanomethyl)-2-[3-[4-(4-hydroxy-4-piperidyl)phenyl]phenyl]-4-methyl-valeramide Formula: C25H31N3O2 MolecularWeight: 405.53254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC(=C1)C2=CC=C(C=C2)C3(CCNCC3)O)C(=O)NCC#N

Isomeric SMILES

CC(C)CC(C1=CC=CC(=C1)C2=CC=C(C=C2)C3(CCNCC3)O)C(=O)NCC#N

InChI

InChI=1S/C25H31N3O2/c1-18(2)16-23(24(29)28-15-12-26)21-5-3-4-20(17-21)19-6-8-22(9-7-19)25(30)10-13-27-14-11-25/h3-9,17-18,23,27,30H,10-11,13-16H2,1-2H3,(H,28,29)