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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(=O)OC)C#CC2=CC(=CC=C2)OC)OC3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC(=O)OC)C#CC2=CC(=CC=C2)OC)OC3CCCC3

InChI

InChI=1S/C25H28O5/c1-27-22-10-6-7-18(15-22)11-12-20(17-25(26)29-3)19-13-14-23(28-2)24(16-19)30-21-8-4-5-9-21/h6-7,10,13-16,20-21H,4-5,8-9,17H2,1-3H3