2-methyl-N-(5-nitro-2-oxidanyl-phenyl)pentanamide

Systemtic Name: 2-methyl-N-(5-nitro-2-oxidanyl-phenyl)pentanamide Openeye Name: N-(2-hydroxy-5-nitro-phenyl)-2-methyl-pentanamide CAS Name: N-(2-hydroxy-5-nitrophenyl)-2-methylpentanamide IUPAC Name: N-(2-hydroxy-5-nitrophenyl)-2-methylpentanamide Traditional Name: N-(2-hydroxy-5-nitro-phenyl)-2-methyl-valeramide Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O4/c1-3-4-8(2)12(16)13-10-7-9(14(17)18)5-6-11(10)15/h5-8,15H,3-4H2,1-2H3,(H,13,16)