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

Systemtic Name: 4-[[5-[[4-(hydroxymethyl)-4-[(3-methylphenyl)methyl]piperidin-1-yl]methyl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-[[4-(hydroxymethyl)-4-(m-tolylmethyl)-1-piperidyl]methyl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-[[4-(hydroxymethyl)-4-[(3-methylphenyl)methyl]-1-piperidinyl]methyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-[[4-(hydroxymethyl)-4-[(3-methylphenyl)methyl]piperidin-1-yl]methyl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-[[4-(3-methylbenzyl)-4-methylol-piperidino]methyl]imidazol-1-yl]methyl]benzonitrile Formula: C26H30N4O MolecularWeight: 414.5426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2(CCN(CC2)CC3=CN=CN3CC4=CC=C(C=C4)C#N)CO

Isomeric SMILES

CC1=CC(=CC=C1)CC2(CCN(CC2)CC3=CN=CN3CC4=CC=C(C=C4)C#N)CO

InChI

InChI=1S/C26H30N4O/c1-21-3-2-4-24(13-21)14-26(19-31)9-11-29(12-10-26)18-25-16-28-20-30(25)17-23-7-5-22(15-27)6-8-23/h2-8,13,16,20,31H,9-12,14,17-19H2,1H3