N-[3-(2-methyl-2-nitro-1-oxidanyl-propyl)phenyl]ethanamide

Systemtic Name: N-[3-(2-methyl-2-nitro-1-oxidanyl-propyl)phenyl]ethanamide Openeye Name: N-[3-(1-hydroxy-2-methyl-2-nitro-propyl)phenyl]acetamide CAS Name: N-[3-(1-hydroxy-2-methyl-2-nitropropyl)phenyl]acetamide IUPAC Name: N-[3-(1-hydroxy-2-methyl-2-nitropropyl)phenyl]acetamide Traditional Name: N-[3-(1-hydroxy-2-methyl-2-nitro-propyl)phenyl]acetamide Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O4/c1-8(15)13-10-6-4-5-9(7-10)11(16)12(2,3)14(17)18/h4-7,11,16H,1-3H3,(H,13,15)