methyl 2,4,5-trimethoxy-3-nitro-benzoate

Systemtic Name: methyl 2,4,5-trimethoxy-3-nitro-benzoate Openeye Name: methyl 2,4,5-trimethoxy-3-nitro-benzoate CAS Name: 2,4,5-trimethoxy-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 2,4,5-trimethoxy-3-nitrobenzoate Traditional Name: 2,4,5-trimethoxy-3-nitro-benzoic acid methyl ester Formula: C11H13NO7 MolecularWeight: 271.22342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)OC)OC)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)OC)OC)[N+](=O)[O-])OC

InChI

InChI=1S/C11H13NO7/c1-16-7-5-6(11(13)19-4)9(17-2)8(12(14)15)10(7)18-3/h5H,1-4H3