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

Systemtic Name: 4-[[5-[[4-(methoxymethyl)-4-[(3-methylphenyl)methyl]piperidin-1-yl]methyl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-[[4-(methoxymethyl)-4-(m-tolylmethyl)-1-piperidyl]methyl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-[[4-(methoxymethyl)-4-[(3-methylphenyl)methyl]-1-piperidinyl]methyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-[[4-(methoxymethyl)-4-[(3-methylphenyl)methyl]piperidin-1-yl]methyl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-[[4-(methoxymethyl)-4-(3-methylbenzyl)piperidino]methyl]imidazol-1-yl]methyl]benzonitrile Formula: C27H32N4O MolecularWeight: 428.56918

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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)COC

Isomeric SMILES

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

InChI

InChI=1S/C27H32N4O/c1-22-4-3-5-25(14-22)15-27(20-32-2)10-12-30(13-11-27)19-26-17-29-21-31(26)18-24-8-6-23(16-28)7-9-24/h3-9,14,17,21H,10-13,15,18-20H2,1-2H3