methyl 2-[2-(1H-pyrrolo[2,3-b]pyridin-4-yl)ethynyl]benzoate

Systemtic Name: methyl 2-[2-(1H-pyrrolo[2,3-b]pyridin-4-yl)ethynyl]benzoate Openeye Name: methyl 2-[2-(1H-pyrrolo[2,3-b]pyridin-4-yl)ethynyl]benzoate CAS Name: 2-[2-(1H-pyrrolo[2,3-b]pyridin-4-yl)ethynyl]benzoic acid methyl ester IUPAC Name: methyl 2-[2-(1H-pyrrolo[2,3-b]pyridin-4-yl)ethynyl]benzoate Traditional Name: 2-[2-(1H-pyrrolo[2,3-b]pyridin-4-yl)ethynyl]benzoic acid methyl ester Formula: C17H12N2O2 MolecularWeight: 276.28938

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C#CC2=C3C=CNC3=NC=C2

Isomeric SMILES

COC(=O)C1=CC=CC=C1C#CC2=C3C=CNC3=NC=C2

InChI

InChI=1S/C17H12N2O2/c1-21-17(20)15-5-3-2-4-12(15)6-7-13-8-10-18-16-14(13)9-11-19-16/h2-5,8-11H,1H3,(H,18,19)