(5-methanoyl-2-methoxy-3-nitro-6-propyl-phenyl) ethanoate

Systemtic Name: (5-methanoyl-2-methoxy-3-nitro-6-propyl-phenyl) ethanoate Openeye Name: (5-formyl-2-methoxy-3-nitro-6-propyl-phenyl) acetate CAS Name: acetic acid (5-formyl-2-methoxy-3-nitro-6-propylphenyl) ester IUPAC Name: (5-formyl-2-methoxy-3-nitro-6-propylphenyl) acetate Traditional Name: acetic acid (5-formyl-2-methoxy-3-nitro-6-propyl-phenyl) ester Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(C=C1C=O)[N+](=O)[O-])OC)OC(=O)C

Isomeric SMILES

CCCC1=C(C(=C(C=C1C=O)[N+](=O)[O-])OC)OC(=O)C

InChI

InChI=1S/C13H15NO6/c1-4-5-10-9(7-15)6-11(14(17)18)13(19-3)12(10)20-8(2)16/h6-7H,4-5H2,1-3H3