(2-ethoxycarbonylphenyl) 3,5-dinitrobenzoate

Systemtic Name: (2-ethoxycarbonylphenyl) 3,5-dinitrobenzoate Openeye Name: (2-ethoxycarbonylphenyl) 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (2-ethoxycarbonylphenyl) ester IUPAC Name: (2-ethoxycarbonylphenyl) 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (2-carbethoxyphenyl) ester Formula: C16H12N2O8 MolecularWeight: 360.27508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O8/c1-2-25-16(20)13-5-3-4-6-14(13)26-15(19)10-7-11(17(21)22)9-12(8-10)18(23)24/h3-9H,2H2,1H3