(4-nitrophenyl)methyl 2,4-dinitrobenzoate

Systemtic Name: (4-nitrophenyl)methyl 2,4-dinitrobenzoate Openeye Name: (4-nitrophenyl)methyl 2,4-dinitrobenzoate CAS Name: 2,4-dinitrobenzoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2,4-dinitrobenzoate Traditional Name: 2,4-dinitrobenzoic acid (4-nitrobenzyl) ester Formula: C14H9N3O8 MolecularWeight: 347.23656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H9N3O8/c18-14(25-8-9-1-3-10(4-2-9)15(19)20)12-6-5-11(16(21)22)7-13(12)17(23)24/h1-7H,8H2