3-acetyloxy-4-methyl-2-nitro-benzoate

Systemtic Name: 3-acetyloxy-4-methyl-2-nitro-benzoate Openeye Name: 3-acetoxy-4-methyl-2-nitro-benzoate CAS Name: 3-acetyloxy-4-methyl-2-nitrobenzoate IUPAC Name: 3-acetyloxy-4-methyl-2-nitrobenzoate Traditional Name: 3-acetoxy-4-methyl-2-nitro-benzoate Formula: C10H8NO6- MolecularWeight: 238.17362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)[O-])[N+](=O)[O-])OC(=O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)[O-])[N+](=O)[O-])OC(=O)C

InChI

InChI=1S/C10H9NO6/c1-5-3-4-7(10(13)14)8(11(15)16)9(5)17-6(2)12/h3-4H,1-2H3,(H,13,14)/p-1