2-(3-acetyloxy-5-ethyl-4-nitro-phenyl)ethanoate

Systemtic Name: 2-(3-acetyloxy-5-ethyl-4-nitro-phenyl)ethanoate Openeye Name: 2-(3-acetoxy-5-ethyl-4-nitro-phenyl)acetate CAS Name: 2-(3-acetyloxy-5-ethyl-4-nitrophenyl)acetate IUPAC Name: 2-(3-acetyloxy-5-ethyl-4-nitrophenyl)acetate Traditional Name: 2-(3-acetoxy-5-ethyl-4-nitro-phenyl)acetate Formula: C12H12NO6- MolecularWeight: 266.22678

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)CC(=O)[O-])OC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C(=CC(=C1)CC(=O)[O-])OC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C12H13NO6/c1-3-9-4-8(6-11(15)16)5-10(19-7(2)14)12(9)13(17)18/h4-5H,3,6H2,1-2H3,(H,15,16)/p-1