1-[(3R)-1-cyclohexylpiperidin-3-yl]-N-[(2,5-dimethoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)methanamine

Systemtic Name: 1-[(3R)-1-cyclohexylpiperidin-3-yl]-N-[(2,5-dimethoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)methanamine Openeye Name: 1-[(3R)-1-cyclohexyl-3-piperidyl]-N-[(2,5-dimethoxyphenyl)methyl]-N-(3-pyridylmethyl)methanamine CAS Name: 1-[(3R)-1-cyclohexyl-3-piperidinyl]-N-[(2,5-dimethoxyphenyl)methyl]-N-(3-pyridinylmethyl)methanamine IUPAC Name: 1-[(3R)-1-cyclohexylpiperidin-3-yl]-N-[(2,5-dimethoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)methanamine Traditional Name: [(3R)-1-cyclohexyl-3-piperidyl]methyl-(2,5-dimethoxybenzyl)-(3-pyridylmethyl)amine Formula: C27H39N3O2 MolecularWeight: 437.61746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN(CC2CCCN(C2)C3CCCCC3)CC4=CN=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN(C[C@H]2CCCN(C2)C3CCCCC3)CC4=CN=CC=C4

InChI

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