4-[[5-[[4-[(3-methylphenyl)-oxidanyl-methyl]piperidin-1-yl]methyl]imidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[5-[[4-[(3-methylphenyl)-oxidanyl-methyl]piperidin-1-yl]methyl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-[[4-[hydroxy(m-tolyl)methyl]-1-piperidyl]methyl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-[[4-[hydroxy-(3-methylphenyl)methyl]-1-piperidinyl]methyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-[[4-[hydroxy-(3-methylphenyl)methyl]piperidin-1-yl]methyl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-[[4-[hydroxy(m-tolyl)methyl]piperidino]methyl]imidazol-1-yl]methyl]benzonitrile Formula: C25H28N4O MolecularWeight: 400.51602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2CCN(CC2)CC3=CN=CN3CC4=CC=C(C=C4)C#N)O

Isomeric SMILES

CC1=CC(=CC=C1)C(C2CCN(CC2)CC3=CN=CN3CC4=CC=C(C=C4)C#N)O

InChI

InChI=1S/C25H28N4O/c1-19-3-2-4-23(13-19)25(30)22-9-11-28(12-10-22)17-24-15-27-18-29(24)16-21-7-5-20(14-26)6-8-21/h2-8,13,15,18,22,25,30H,9-12,16-17H2,1H3