(2-methanoyl-4-nitro-phenyl) 3,5-dinitrobenzoate

Systemtic Name: (2-methanoyl-4-nitro-phenyl) 3,5-dinitrobenzoate Openeye Name: (2-formyl-4-nitro-phenyl) 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (2-formyl-4-nitrophenyl) ester IUPAC Name: (2-formyl-4-nitrophenyl) 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (2-formyl-4-nitro-phenyl) ester Formula: C14H7N3O9 MolecularWeight: 361.22008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H7N3O9/c18-7-9-5-10(15(20)21)1-2-13(9)26-14(19)8-3-11(16(22)23)6-12(4-8)17(24)25/h1-7H