(phenylmethyl) 2-oxidanylidene-6-(trifluoromethyl)-1,3-dihydropyrrolo[3,2-b]pyridine-3-carboxylate

Systemtic Name: (phenylmethyl) 2-oxidanylidene-6-(trifluoromethyl)-1,3-dihydropyrrolo[3,2-b]pyridine-3-carboxylate Openeye Name: benzyl 2-oxo-6-(trifluoromethyl)-1,3-dihydropyrrolo[3,2-b]pyridine-3-carboxylate CAS Name: 2-oxo-6-(trifluoromethyl)-1,3-dihydropyrrolo[3,2-b]pyridine-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-oxo-6-(trifluoromethyl)-1,3-dihydropyrrolo[3,2-b]pyridine-3-carboxylate Traditional Name: 2-keto-6-(trifluoromethyl)-1,3-dihydropyrrolo[3,2-b]pyridine-3-carboxylic acid benzyl ester Formula: C16H11F3N2O3 MolecularWeight: 336.26535

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2C3=C(C=C(C=N3)C(F)(F)F)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2C3=C(C=C(C=N3)C(F)(F)F)NC2=O

InChI

InChI=1S/C16H11F3N2O3/c17-16(18,19)10-6-11-13(20-7-10)12(14(22)21-11)15(23)24-8-9-4-2-1-3-5-9/h1-7,12H,8H2,(H,21,22)