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

Systemtic Name: methyl 3-(3-cyclopentyloxy-4-methoxy-phenyl)-5-(3-ethanoylphenyl)pent-4-ynoate Openeye Name: methyl 5-(3-acetylphenyl)-3-[3-(cyclopentoxy)-4-methoxy-phenyl]pent-4-ynoate CAS Name: 5-(3-acetylphenyl)-3-(3-cyclopentyloxy-4-methoxyphenyl)-4-pentynoic acid methyl ester IUPAC Name: methyl 5-(3-acetylphenyl)-3-(3-cyclopentyloxy-4-methoxyphenyl)pent-4-ynoate Traditional Name: 5-(3-acetylphenyl)-3-[3-(cyclopentoxy)-4-methoxy-phenyl]pent-4-ynoic acid methyl ester Formula: C26H28O5 MolecularWeight: 420.49752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28O5/c1-18(27)20-8-6-7-19(15-20)11-12-22(17-26(28)30-3)21-13-14-24(29-2)25(16-21)31-23-9-4-5-10-23/h6-8,13-16,22-23H,4-5,9-10,17H2,1-3H3