methyl 3-(3-cyclopentyloxy-4-methoxy-phenyl)-5-(4-methoxyphenyl)pent-4-ynoate

Systemtic Name: methyl 3-(3-cyclopentyloxy-4-methoxy-phenyl)-5-(4-methoxyphenyl)pent-4-ynoate Openeye Name: methyl 3-[3-(cyclopentoxy)-4-methoxy-phenyl]-5-(4-methoxyphenyl)pent-4-ynoate CAS Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)-5-(4-methoxyphenyl)-4-pentynoic acid methyl ester IUPAC Name: methyl 3-(3-cyclopentyloxy-4-methoxyphenyl)-5-(4-methoxyphenyl)pent-4-ynoate Traditional Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]-5-(4-methoxyphenyl)pent-4-ynoic acid methyl ester Formula: C25H28O5 MolecularWeight: 408.48682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C#CC(CC(=O)OC)C2=CC(=C(C=C2)OC)OC3CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)C#CC(CC(=O)OC)C2=CC(=C(C=C2)OC)OC3CCCC3

InChI

InChI=1S/C25H28O5/c1-27-21-13-9-18(10-14-21)8-11-20(17-25(26)29-3)19-12-15-23(28-2)24(16-19)30-22-6-4-5-7-22/h9-10,12-16,20,22H,4-7,17H2,1-3H3