methyl 4,6-bis(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 4,6-bis(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 4,6-bis(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 4,6-bis(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester IUPAC Name: methyl 4,6-bis(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 4,6-bis(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C11H6F6N2O2 MolecularWeight: 312.167959

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(N1)N=C(C=C2C(F)(F)F)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC2=C(N1)N=C(C=C2C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C11H6F6N2O2/c1-21-9(20)6-2-4-5(10(12,13)14)3-7(11(15,16)17)19-8(4)18-6/h2-3H,1H3,(H,18,19)