methyl 5-[3,4-bis(fluoranyl)phenyl]-3-(3-cyclopentyloxy-4-methoxy-phenyl)pent-4-ynoate

Systemtic Name: methyl 5-[3,4-bis(fluoranyl)phenyl]-3-(3-cyclopentyloxy-4-methoxy-phenyl)pent-4-ynoate Openeye Name: methyl 3-[3-(cyclopentoxy)-4-methoxy-phenyl]-5-(3,4-difluorophenyl)pent-4-ynoate CAS Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)-5-(3,4-difluorophenyl)-4-pentynoic acid methyl ester IUPAC Name: methyl 3-(3-cyclopentyloxy-4-methoxyphenyl)-5-(3,4-difluorophenyl)pent-4-ynoate Traditional Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]-5-(3,4-difluorophenyl)pent-4-ynoic acid methyl ester Formula: C24H24F2O4 MolecularWeight: 414.441766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24F2O4/c1-28-22-12-10-17(14-23(22)30-19-5-3-4-6-19)18(15-24(27)29-2)9-7-16-8-11-20(25)21(26)13-16/h8,10-14,18-19H,3-6,15H2,1-2H3