N-(3-acetamido-4-fluoranyl-phenyl)-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide

Systemtic Name: N-(3-acetamido-4-fluoranyl-phenyl)-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N-(3-acetamido-4-fluoro-phenyl)-2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N-(3-acetamido-4-fluorophenyl)-2-(4-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-(3-acetamido-4-fluorophenyl)-2-(4-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: N-(3-acetamido-4-fluoro-phenyl)-2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetamide Formula: C18H13FN4O6 MolecularWeight: 400.317423

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)NC(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])F

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)NC(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])F

InChI

InChI=1S/C18H13FN4O6/c1-9(24)20-13-7-10(5-6-12(13)19)21-15(25)8-22-17(26)11-3-2-4-14(23(28)29)16(11)18(22)27/h2-7H,8H2,1H3,(H,20,24)(H,21,25)