[4-(phenylcarbonyl)phenyl] 4,5-dimethoxy-2-nitro-benzoate

Systemtic Name: [4-(phenylcarbonyl)phenyl] 4,5-dimethoxy-2-nitro-benzoate Openeye Name: (4-benzoylphenyl) 4,5-dimethoxy-2-nitro-benzoate CAS Name: 4,5-dimethoxy-2-nitrobenzoic acid (4-benzoylphenyl) ester IUPAC Name: (4-benzoylphenyl) 4,5-dimethoxy-2-nitrobenzoate Traditional Name: 4,5-dimethoxy-2-nitro-benzoic acid (4-benzoylphenyl) ester Formula: C22H17NO7 MolecularWeight: 407.37288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H17NO7/c1-28-19-12-17(18(23(26)27)13-20(19)29-2)22(25)30-16-10-8-15(9-11-16)21(24)14-6-4-3-5-7-14/h3-13H,1-2H3