(2-nitrophenyl) 3,5-dinitrobenzoate

Systemtic Name: (2-nitrophenyl) 3,5-dinitrobenzoate Openeye Name: (2-nitrophenyl) 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (2-nitrophenyl) ester IUPAC Name: (2-nitrophenyl) 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (2-nitrophenyl) ester Formula: C13H7N3O8 MolecularWeight: 333.20998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H7N3O8/c17-13(24-12-4-2-1-3-11(12)16(22)23)8-5-9(14(18)19)7-10(6-8)15(20)21/h1-7H