3-azanyl-7-fluoranyl-6-(4-methylpiperazin-4-ium-1-yl)quinoxaline-2-carbonitrile

Systemtic Name: 3-azanyl-7-fluoranyl-6-(4-methylpiperazin-4-ium-1-yl)quinoxaline-2-carbonitrile Openeye Name: 3-amino-7-fluoro-6-(4-methylpiperazin-4-ium-1-yl)quinoxaline-2-carbonitrile CAS Name: 3-amino-7-fluoro-6-(4-methyl-1-piperazin-4-iumyl)-2-quinoxalinecarbonitrile IUPAC Name: 3-amino-7-fluoro-6-(4-methylpiperazin-4-ium-1-yl)quinoxaline-2-carbonitrile Traditional Name: 3-amino-7-fluoro-6-(4-methylpiperazin-4-ium-1-yl)quinoxaline-2-carbonitrile Formula: C14H16FN6+ MolecularWeight: 287.315443

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C3C(=C2)N=C(C(=N3)C#N)N)F

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C3C(=C2)N=C(C(=N3)C#N)N)F

InChI

InChI=1S/C14H15FN6/c1-20-2-4-21(5-3-20)13-7-11-10(6-9(13)15)18-12(8-16)14(17)19-11/h6-7H,2-5H2,1H3,(H2,17,19)/p+1