2-[[[(3R)-1-cyclohexylpiperidin-3-yl]methyl-(pyridin-3-ylmethyl)amino]methyl]-6-ethoxy-phenol

Systemtic Name: 2-[[[(3R)-1-cyclohexylpiperidin-3-yl]methyl-(pyridin-3-ylmethyl)amino]methyl]-6-ethoxy-phenol Openeye Name: 2-[[[(3R)-1-cyclohexyl-3-piperidyl]methyl-(3-pyridylmethyl)amino]methyl]-6-ethoxy-phenol CAS Name: 2-[[[(3R)-1-cyclohexyl-3-piperidinyl]methyl-(3-pyridinylmethyl)amino]methyl]-6-ethoxyphenol IUPAC Name: 2-[[[(3R)-1-cyclohexylpiperidin-3-yl]methyl-(pyridin-3-ylmethyl)amino]methyl]-6-ethoxyphenol Traditional Name: 2-[[[(3R)-1-cyclohexyl-3-piperidyl]methyl-(3-pyridylmethyl)amino]methyl]-6-ethoxy-phenol Formula: C27H39N3O2 MolecularWeight: 437.61746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)CN(CC2CCCN(C2)C3CCCCC3)CC4=CN=CC=C4

Isomeric SMILES

CCOC1=CC=CC(=C1O)CN(C[C@H]2CCCN(C2)C3CCCCC3)CC4=CN=CC=C4

InChI

InChI=1S/C27H39N3O2/c1-2-32-26-14-6-11-24(27(26)31)21-29(18-22-9-7-15-28-17-22)19-23-10-8-16-30(20-23)25-12-4-3-5-13-25/h6-7,9,11,14-15,17,23,25,31H,2-5,8,10,12-13,16,18-21H2,1H3/t23-/m1/s1