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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(CCC1)(C#CC2=CC=NC=C2)C3=CC(=C(C=C3)OC)OC4CCCC4

Isomeric SMILES

COC1=CC(CCC1)(C#CC2=CC=NC=C2)C3=CC(=C(C=C3)OC)OC4CCCC4

InChI

InChI=1S/C26H29NO3/c1-28-23-8-5-14-26(19-23,15-11-20-12-16-27-17-13-20)21-9-10-24(29-2)25(18-21)30-22-6-3-4-7-22/h9-10,12-13,16-19,22H,3-8,14H2,1-2H3