2-fluoranyl-5-nitro-N-pentan-2-yl-benzamide

Systemtic Name: 2-fluoranyl-5-nitro-N-pentan-2-yl-benzamide Openeye Name: 2-fluoro-N-(1-methylbutyl)-5-nitro-benzamide CAS Name: 2-fluoro-5-nitro-N-pentan-2-ylbenzamide IUPAC Name: 2-fluoro-5-nitro-N-pentan-2-ylbenzamide Traditional Name: 2-fluoro-N-(1-methylbutyl)-5-nitro-benzamide Formula: C12H15FN2O3 MolecularWeight: 254.257503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15FN2O3/c1-3-4-8(2)14-12(16)10-7-9(15(17)18)5-6-11(10)13/h5-8H,3-4H2,1-2H3,(H,14,16)