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

Systemtic Name: [4-(3-cyclopentyloxy-4-methoxy-phenyl)-4-(2-pyridin-4-ylethynyl)cyclohexyl]methanol Openeye Name: [4-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-[2-(4-pyridyl)ethynyl]cyclohexyl]methanol CAS Name: [4-(3-cyclopentyloxy-4-methoxyphenyl)-4-(2-pyridin-4-ylethynyl)cyclohexyl]methanol IUPAC Name: [4-(3-cyclopentyloxy-4-methoxyphenyl)-4-(2-pyridin-4-ylethynyl)cyclohexyl]methanol Traditional Name: [4-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-[2-(4-pyridyl)ethynyl]cyclohexyl]methanol Formula: C26H31NO3 MolecularWeight: 405.52924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31NO3/c1-29-24-7-6-22(18-25(24)30-23-4-2-3-5-23)26(14-9-21(19-28)10-15-26)13-8-20-11-16-27-17-12-20/h6-7,11-12,16-18,21,23,28H,2-5,9-10,14-15,19H2,1H3