2-(aminocarbonylamino)-N-(4-fluoranyl-3-nitro-phenyl)-3-methyl-butanamide

Systemtic Name: 2-(aminocarbonylamino)-N-(4-fluoranyl-3-nitro-phenyl)-3-methyl-butanamide Openeye Name: N-(4-fluoro-3-nitro-phenyl)-3-methyl-2-ureido-butanamide CAS Name: 2-(carbamoylamino)-N-(4-fluoro-3-nitrophenyl)-3-methylbutanamide IUPAC Name: 2-(carbamoylamino)-N-(4-fluoro-3-nitrophenyl)-3-methylbutanamide Traditional Name: N-(4-fluoro-3-nitro-phenyl)-3-methyl-2-ureido-butyramide Formula: C12H15FN4O4 MolecularWeight: 298.270303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15FN4O4/c1-6(2)10(16-12(14)19)11(18)15-7-3-4-8(13)9(5-7)17(20)21/h3-6,10H,1-2H3,(H,15,18)(H3,14,16,19)