methyl 2-[2-(2,4-dinitrophenyl)ethanoyl]benzoate

Systemtic Name: methyl 2-[2-(2,4-dinitrophenyl)ethanoyl]benzoate Openeye Name: methyl 2-[2-(2,4-dinitrophenyl)acetyl]benzoate CAS Name: 2-[2-(2,4-dinitrophenyl)-1-oxoethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[2-(2,4-dinitrophenyl)acetyl]benzoate Traditional Name: 2-[2-(2,4-dinitrophenyl)acetyl]benzoic acid methyl ester Formula: C16H12N2O7 MolecularWeight: 344.27568

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C(=O)CC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=CC=C1C(=O)CC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O7/c1-25-16(20)13-5-3-2-4-12(13)15(19)8-10-6-7-11(17(21)22)9-14(10)18(23)24/h2-7,9H,8H2,1H3