4-(3-cyclopentyloxy-4-methoxy-phenyl)-4-(2-pyridin-2-ylethynyl)cyclohexan-1-ol

Systemtic Name: 4-(3-cyclopentyloxy-4-methoxy-phenyl)-4-(2-pyridin-2-ylethynyl)cyclohexan-1-ol Openeye Name: 4-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-[2-(2-pyridyl)ethynyl]cyclohexanol CAS Name: 4-(3-cyclopentyloxy-4-methoxyphenyl)-4-[2-(2-pyridinyl)ethynyl]-1-cyclohexanol IUPAC Name: 4-(3-cyclopentyloxy-4-methoxyphenyl)-4-(2-pyridin-2-ylethynyl)cyclohexan-1-ol Traditional Name: 4-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-[2-(2-pyridyl)ethynyl]cyclohexanol Formula: C25H29NO3 MolecularWeight: 391.50266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCC(CC2)O)C#CC3=CC=CC=N3)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCC(CC2)O)C#CC3=CC=CC=N3)OC4CCCC4

InChI

InChI=1S/C25H29NO3/c1-28-23-10-9-19(18-24(23)29-22-7-2-3-8-22)25(15-12-21(27)13-16-25)14-11-20-6-4-5-17-26-20/h4-6,9-10,17-18,21-22,27H,2-3,7-8,12-13,15-16H2,1H3