[3-[(E)-hydroxyiminomethyl]phenyl] 3,5-dinitrobenzoate

Systemtic Name: [3-[(E)-hydroxyiminomethyl]phenyl] 3,5-dinitrobenzoate Openeye Name: [3-[(E)-hydroxyiminomethyl]phenyl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [3-[(E)-hydroxyiminomethyl]phenyl] ester IUPAC Name: [3-[(E)-hydroxyiminomethyl]phenyl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [3-[(E)-hydroximinomethyl]phenyl] ester Formula: C14H9N3O7 MolecularWeight: 331.23716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C=NO

Isomeric SMILES

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

InChI

InChI=1S/C14H9N3O7/c18-14(24-13-3-1-2-9(4-13)8-15-19)10-5-11(16(20)21)7-12(6-10)17(22)23/h1-8,19H/b15-8+