4,6-bis(azanyl)-1-(4-fluorophenyl)-2-oxidanylidene-3H-pyrrolo[2,3-b]pyridin-7-ium-5-carbonitrile

Systemtic Name: 4,6-bis(azanyl)-1-(4-fluorophenyl)-2-oxidanylidene-3H-pyrrolo[2,3-b]pyridin-7-ium-5-carbonitrile Openeye Name: 4,6-diamino-1-(4-fluorophenyl)-2-oxo-3H-pyrrolo[2,3-b]pyridin-7-ium-5-carbonitrile CAS Name: 4,6-diamino-1-(4-fluorophenyl)-2-oxo-3H-pyrrolo[2,3-b]pyridin-7-ium-5-carbonitrile IUPAC Name: 4,6-diamino-1-(4-fluorophenyl)-2-oxo-3H-pyrrolo[2,3-b]pyridin-7-ium-5-carbonitrile Traditional Name: 4,6-diamino-1-(4-fluorophenyl)-2-keto-3H-pyrrolo[2,3-b]pyridin-7-ium-5-carbonitrile Formula: C14H11FN5O+ MolecularWeight: 284.268443

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C([NH+]=C(C(=C2N)C#N)N)N(C1=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1C2=C([NH+]=C(C(=C2N)C#N)N)N(C1=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C14H10FN5O/c15-7-1-3-8(4-2-7)20-11(21)5-9-12(17)10(6-16)13(18)19-14(9)20/h1-4H,5H2,(H4,17,18,19)/p+1