methyl 4-[[4-[[2-(phenoxymethyl)benzimidazol-1-yl]methyl]piperidin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[4-[[2-(phenoxymethyl)benzimidazol-1-yl]methyl]piperidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-[[2-(phenoxymethyl)benzimidazol-1-yl]methyl]-1-piperidyl]methyl]benzoate CAS Name: 4-[[4-[[2-(phenoxymethyl)-1-benzimidazolyl]methyl]-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[[2-(phenoxymethyl)benzimidazol-1-yl]methyl]piperidin-1-yl]methyl]benzoate Traditional Name: 4-[[4-[[2-(phenoxymethyl)benzimidazol-1-yl]methyl]piperidino]methyl]benzoic acid methyl ester Formula: C29H31N3O3 MolecularWeight: 469.57474

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2CCC(CC2)CN3C4=CC=CC=C4N=C3COC5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2CCC(CC2)CN3C4=CC=CC=C4N=C3COC5=CC=CC=C5

InChI

InChI=1S/C29H31N3O3/c1-34-29(33)24-13-11-22(12-14-24)19-31-17-15-23(16-18-31)20-32-27-10-6-5-9-26(27)30-28(32)21-35-25-7-3-2-4-8-25/h2-14,23H,15-21H2,1H3