2-azanyl-N-butan-2-yl-1-(4-fluoranyl-3-nitro-phenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N-butan-2-yl-1-(4-fluoranyl-3-nitro-phenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(4-fluoro-3-nitro-phenyl)-N-sec-butyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-butan-2-yl-1-(4-fluoro-3-nitrophenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-butan-2-yl-1-(4-fluoro-3-nitrophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(4-fluoro-3-nitro-phenyl)-N-sec-butyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C21H19FN6O3 MolecularWeight: 422.412363

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC(=C(C=C4)F)[N+](=O)[O-])N

Isomeric SMILES

CCC(C)NC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC(=C(C=C4)F)[N+](=O)[O-])N

InChI

InChI=1S/C21H19FN6O3/c1-3-11(2)24-21(29)17-18-20(26-15-7-5-4-6-14(15)25-18)27(19(17)23)12-8-9-13(22)16(10-12)28(30)31/h4-11H,3,23H2,1-2H3,(H,24,29)