2-(3-methylphenyl)-1-[4-[[2-(phenoxymethyl)benzimidazol-1-yl]methyl]piperidin-1-yl]ethanone

Systemtic Name: 2-(3-methylphenyl)-1-[4-[[2-(phenoxymethyl)benzimidazol-1-yl]methyl]piperidin-1-yl]ethanone Openeye Name: 2-(m-tolyl)-1-[4-[[2-(phenoxymethyl)benzimidazol-1-yl]methyl]-1-piperidyl]ethanone CAS Name: 2-(3-methylphenyl)-1-[4-[[2-(phenoxymethyl)-1-benzimidazolyl]methyl]-1-piperidinyl]ethanone IUPAC Name: 2-(3-methylphenyl)-1-[4-[[2-(phenoxymethyl)benzimidazol-1-yl]methyl]piperidin-1-yl]ethanone Traditional Name: 2-(m-tolyl)-1-[4-[[2-(phenoxymethyl)benzimidazol-1-yl]methyl]piperidino]ethanone Formula: C29H31N3O2 MolecularWeight: 453.57534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC(=O)N2CCC(CC2)CN3C4=CC=CC=C4N=C3COC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)CC(=O)N2CCC(CC2)CN3C4=CC=CC=C4N=C3COC5=CC=CC=C5

InChI

InChI=1S/C29H31N3O2/c1-22-8-7-9-24(18-22)19-29(33)31-16-14-23(15-17-31)20-32-27-13-6-5-12-26(27)30-28(32)21-34-25-10-3-2-4-11-25/h2-13,18,23H,14-17,19-21H2,1H3