ethyl 3-methyl-2-oxidanylidene-5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxylate

Systemtic Name: ethyl 3-methyl-2-oxidanylidene-5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxylate Openeye Name: ethyl 3-methyl-2-oxo-5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxylate CAS Name: 3-methyl-2-oxo-5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-2-oxo-5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxylate Traditional Name: 2-keto-3-methyl-5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid ethyl ester Formula: C12H11F3N2O3 MolecularWeight: 288.22255

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C2=CC(=CN=C2NC1=O)C(F)(F)F)C

Isomeric SMILES

CCOC(=O)C1(C2=CC(=CN=C2NC1=O)C(F)(F)F)C

InChI

InChI=1S/C12H11F3N2O3/c1-3-20-10(19)11(2)7-4-6(12(13,14)15)5-16-8(7)17-9(11)18/h4-5H,3H2,1-2H3,(H,16,17,18)