[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-(5-bromanyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methanone

Systemtic Name: [2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-(5-bromanyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methanone Openeye Name: (5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-(2,2-difluoro-1,3-benzodioxol-5-yl)methanone CAS Name: (5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-(2,2-difluoro-1,3-benzodioxol-5-yl)methanone IUPAC Name: (5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-(2,2-difluoro-1,3-benzodioxol-5-yl)methanone Traditional Name: (5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-(2,2-difluoro-1,3-benzodioxol-5-yl)methanone Formula: C15H7BrF2N2O3 MolecularWeight: 381.128486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)C3=CNC4=NC=C(C=C34)Br)OC(O2)(F)F

Isomeric SMILES

C1=CC2=C(C=C1C(=O)C3=CNC4=NC=C(C=C34)Br)OC(O2)(F)F

InChI

InChI=1S/C15H7BrF2N2O3/c16-8-4-9-10(6-20-14(9)19-5-8)13(21)7-1-2-11-12(3-7)23-15(17,18)22-11/h1-6H,(H,19,20)