(4-phenylmethoxycarbonylphenyl) 3,5-dinitrobenzoate

Systemtic Name: (4-phenylmethoxycarbonylphenyl) 3,5-dinitrobenzoate Openeye Name: (4-benzyloxycarbonylphenyl) 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (4-phenylmethoxycarbonylphenyl) ester IUPAC Name: (4-phenylmethoxycarbonylphenyl) 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (4-carbobenzoxyphenyl) ester Formula: C21H14N2O8 MolecularWeight: 422.34446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14N2O8/c24-20(30-13-14-4-2-1-3-5-14)15-6-8-19(9-7-15)31-21(25)16-10-17(22(26)27)12-18(11-16)23(28)29/h1-12H,13H2