2-[3,5-bis(methoxycarbonyl)-4-(2-methylpropyl)-6-(trifluoromethyl)pyridin-2-yl]-2,2-bis(fluoranyl)ethanoic acid

Systemtic Name: 2-[3,5-bis(methoxycarbonyl)-4-(2-methylpropyl)-6-(trifluoromethyl)pyridin-2-yl]-2,2-bis(fluoranyl)ethanoic acid Openeye Name: 2,2-difluoro-2-[4-isobutyl-3,5-bis(methoxycarbonyl)-6-(trifluoromethyl)-2-pyridyl]acetic acid CAS Name: 2-[3,5-bis(methoxycarbonyl)-4-(2-methylpropyl)-6-(trifluoromethyl)-2-pyridinyl]-2,2-difluoroacetic acid IUPAC Name: 2-[3,5-bis(methoxycarbonyl)-4-(2-methylpropyl)-6-(trifluoromethyl)pyridin-2-yl]-2,2-difluoroacetic acid Traditional Name: 2-[3,5-dicarbomethoxy-4-isobutyl-6-(trifluoromethyl)-2-pyridyl]-2,2-difluoro-acetic acid Formula: C16H16F5NO6 MolecularWeight: 413.293356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C(=NC(=C1C(=O)OC)C(F)(F)F)C(C(=O)O)(F)F)C(=O)OC

Isomeric SMILES

CC(C)CC1=C(C(=NC(=C1C(=O)OC)C(F)(F)F)C(C(=O)O)(F)F)C(=O)OC

InChI

InChI=1S/C16H16F5NO6/c1-6(2)5-7-8(12(23)27-3)10(15(17,18)14(25)26)22-11(16(19,20)21)9(7)13(24)28-4/h6H,5H2,1-4H3,(H,25,26)