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

Systemtic Name: 3-azanyl-7-fluoranyl-6-(4-methylpiperazin-4-ium-1-yl)quinoxaline-2-carboxamide Openeye Name: 3-amino-7-fluoro-6-(4-methylpiperazin-4-ium-1-yl)quinoxaline-2-carboxamide CAS Name: 3-amino-7-fluoro-6-(4-methyl-1-piperazin-4-iumyl)-2-quinoxalinecarboxamide IUPAC Name: 3-amino-7-fluoro-6-(4-methylpiperazin-4-ium-1-yl)quinoxaline-2-carboxamide Traditional Name: 3-amino-7-fluoro-6-(4-methylpiperazin-4-ium-1-yl)quinoxaline-2-carboxamide Formula: C14H18FN6O+ MolecularWeight: 305.330723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17FN6O/c1-20-2-4-21(5-3-20)11-7-10-9(6-8(11)15)18-12(14(17)22)13(16)19-10/h6-7H,2-5H2,1H3,(H2,16,19)(H2,17,22)/p+1