6-fluoranyl-7-nitro-3-(1-pentylpyrrolo[2,3-b]pyridin-3-yl)-1H-quinoxalin-2-one

Systemtic Name: 6-fluoranyl-7-nitro-3-(1-pentylpyrrolo[2,3-b]pyridin-3-yl)-1H-quinoxalin-2-one Openeye Name: 6-fluoro-7-nitro-3-(1-pentylpyrrolo[2,3-b]pyridin-3-yl)-1H-quinoxalin-2-one CAS Name: 6-fluoro-7-nitro-3-(1-pentyl-3-pyrrolo[2,3-b]pyridinyl)-1H-quinoxalin-2-one IUPAC Name: 6-fluoro-7-nitro-3-(1-pentylpyrrolo[2,3-b]pyridin-3-yl)-1H-quinoxalin-2-one Traditional Name: 3-(1-amylpyrrolo[2,3-b]pyridin-3-yl)-6-fluoro-7-nitro-1H-quinoxalin-2-one Formula: C20H18FN5O3 MolecularWeight: 395.387023

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=C(C2=C1N=CC=C2)C3=NC4=CC(=C(C=C4NC3=O)[N+](=O)[O-])F

Isomeric SMILES

CCCCCN1C=C(C2=C1N=CC=C2)C3=NC4=CC(=C(C=C4NC3=O)[N+](=O)[O-])F

InChI

InChI=1S/C20H18FN5O3/c1-2-3-4-8-25-11-13(12-6-5-7-22-19(12)25)18-20(27)24-16-10-17(26(28)29)14(21)9-15(16)23-18/h5-7,9-11H,2-4,8H2,1H3,(H,24,27)