[4-(3-cyclopentyloxy-4-methoxy-phenyl)-4-(2-pyridin-4-ylethynyl)cyclohexyl]methanamine

Systemtic Name: [4-(3-cyclopentyloxy-4-methoxy-phenyl)-4-(2-pyridin-4-ylethynyl)cyclohexyl]methanamine Openeye Name: [4-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-[2-(4-pyridyl)ethynyl]cyclohexyl]methanamine CAS Name: [4-(3-cyclopentyloxy-4-methoxyphenyl)-4-(2-pyridin-4-ylethynyl)cyclohexyl]methanamine IUPAC Name: [4-(3-cyclopentyloxy-4-methoxyphenyl)-4-(2-pyridin-4-ylethynyl)cyclohexyl]methanamine Traditional Name: [4-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-[2-(4-pyridyl)ethynyl]cyclohexyl]methylamine Formula: C26H32N2O2 MolecularWeight: 404.54448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCC(CC2)CN)C#CC3=CC=NC=C3)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCC(CC2)CN)C#CC3=CC=NC=C3)OC4CCCC4

InChI

InChI=1S/C26H32N2O2/c1-29-24-7-6-22(18-25(24)30-23-4-2-3-5-23)26(14-9-21(19-27)10-15-26)13-8-20-11-16-28-17-12-20/h6-7,11-12,16-18,21,23H,2-5,9-10,14-15,19,27H2,1H3