1-[4-(3-methyl-3-oxidanyl-but-1-ynyl)pyrrolo[2,3-b]pyridin-1-yl]ethanone

Systemtic Name: 1-[4-(3-methyl-3-oxidanyl-but-1-ynyl)pyrrolo[2,3-b]pyridin-1-yl]ethanone Openeye Name: 1-[4-(3-hydroxy-3-methyl-but-1-ynyl)pyrrolo[2,3-b]pyridin-1-yl]ethanone CAS Name: 1-[4-(3-hydroxy-3-methylbut-1-ynyl)-1-pyrrolo[2,3-b]pyridinyl]ethanone IUPAC Name: 1-[4-(3-hydroxy-3-methylbut-1-ynyl)pyrrolo[2,3-b]pyridin-1-yl]ethanone Traditional Name: 1-[4-(3-hydroxy-3-methyl-but-1-ynyl)pyrrolo[2,3-b]pyridin-1-yl]ethanone Formula: C14H14N2O2 MolecularWeight: 242.27316

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=C(C=CN=C21)C#CC(C)(C)O

Isomeric SMILES

CC(=O)N1C=CC2=C(C=CN=C21)C#CC(C)(C)O

InChI

InChI=1S/C14H14N2O2/c1-10(17)16-9-6-12-11(4-7-14(2,3)18)5-8-15-13(12)16/h5-6,8-9,18H,1-3H3