6-fluoranyl-3-[1-(3-morpholin-4-ylpropyl)pyrrolo[2,3-b]pyridin-3-yl]-7-nitro-1H-quinoxalin-2-one

Systemtic Name: 6-fluoranyl-3-[1-(3-morpholin-4-ylpropyl)pyrrolo[2,3-b]pyridin-3-yl]-7-nitro-1H-quinoxalin-2-one Openeye Name: 6-fluoro-3-[1-(3-morpholinopropyl)pyrrolo[2,3-b]pyridin-3-yl]-7-nitro-1H-quinoxalin-2-one CAS Name: 6-fluoro-3-[1-[3-(4-morpholinyl)propyl]-3-pyrrolo[2,3-b]pyridinyl]-7-nitro-1H-quinoxalin-2-one IUPAC Name: 6-fluoro-3-[1-(3-morpholin-4-ylpropyl)pyrrolo[2,3-b]pyridin-3-yl]-7-nitro-1H-quinoxalin-2-one Traditional Name: 6-fluoro-3-[1-(3-morpholinopropyl)pyrrolo[2,3-b]pyridin-3-yl]-7-nitro-1H-quinoxalin-2-one Formula: C22H21FN6O4 MolecularWeight: 452.438343

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN2C=C(C3=C2N=CC=C3)C4=NC5=CC(=C(C=C5NC4=O)[N+](=O)[O-])F

Isomeric SMILES

C1COCCN1CCCN2C=C(C3=C2N=CC=C3)C4=NC5=CC(=C(C=C5NC4=O)[N+](=O)[O-])F

InChI

InChI=1S/C22H21FN6O4/c23-16-11-17-18(12-19(16)29(31)32)26-22(30)20(25-17)15-13-28(21-14(15)3-1-4-24-21)6-2-5-27-7-9-33-10-8-27/h1,3-4,11-13H,2,5-10H2,(H,26,30)