5-methoxycarbonyl-3-methyl-4-[2,2,2-tris(fluoranyl)-1-methoxy-ethyl]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 5-methoxycarbonyl-3-methyl-4-[2,2,2-tris(fluoranyl)-1-methoxy-ethyl]-1H-pyrrole-2-carboxylic acid Openeye Name: 5-methoxycarbonyl-3-methyl-4-(2,2,2-trifluoro-1-methoxy-ethyl)-1H-pyrrole-2-carboxylic acid CAS Name: 5-methoxycarbonyl-3-methyl-4-(2,2,2-trifluoro-1-methoxyethyl)-1H-pyrrole-2-carboxylic acid IUPAC Name: 5-methoxycarbonyl-3-methyl-4-(2,2,2-trifluoro-1-methoxyethyl)-1H-pyrrole-2-carboxylic acid Traditional Name: 5-carbomethoxy-3-methyl-4-(2,2,2-trifluoro-1-methoxy-ethyl)-1H-pyrrole-2-carboxylic acid Formula: C11H12F3NO5 MolecularWeight: 295.21189

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12F3NO5/c1-4-5(8(19-2)11(12,13)14)7(10(18)20-3)15-6(4)9(16)17/h8,15H,1-3H3,(H,16,17)