4-[2-[1-(3-cyclopentyloxy-4-methoxy-phenyl)-4-methoxy-cyclohex-3-en-1-yl]ethynyl]pyridine

Systemtic Name: 4-[2-[1-(3-cyclopentyloxy-4-methoxy-phenyl)-4-methoxy-cyclohex-3-en-1-yl]ethynyl]pyridine Openeye Name: 4-[2-[1-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-methoxy-cyclohex-3-en-1-yl]ethynyl]pyridine CAS Name: 4-[2-[1-(3-cyclopentyloxy-4-methoxyphenyl)-4-methoxy-1-cyclohex-3-enyl]ethynyl]pyridine IUPAC Name: 4-[2-[1-(3-cyclopentyloxy-4-methoxyphenyl)-4-methoxycyclohex-3-en-1-yl]ethynyl]pyridine Traditional Name: 4-[2-[1-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-methoxy-cyclohex-3-en-1-yl]ethynyl]pyridine Formula: C26H29NO3 MolecularWeight: 403.51336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CCC(CC1)(C#CC2=CC=NC=C2)C3=CC(=C(C=C3)OC)OC4CCCC4

Isomeric SMILES

COC1=CCC(CC1)(C#CC2=CC=NC=C2)C3=CC(=C(C=C3)OC)OC4CCCC4

InChI

InChI=1S/C26H29NO3/c1-28-22-10-15-26(16-11-22,14-9-20-12-17-27-18-13-20)21-7-8-24(29-2)25(19-21)30-23-5-3-4-6-23/h7-8,10,12-13,17-19,23H,3-6,11,15-16H2,1-2H3