[3-(phenyliminomethyl)phenyl] 3,5-dinitrobenzoate

Systemtic Name: [3-(phenyliminomethyl)phenyl] 3,5-dinitrobenzoate Openeye Name: [3-(phenyliminomethyl)phenyl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [3-(phenyliminomethyl)phenyl] ester IUPAC Name: [3-(phenyliminomethyl)phenyl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [3-(phenyliminomethyl)phenyl] ester Formula: C20H13N3O6 MolecularWeight: 391.33372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=CC2=CC(=CC=C2)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N=CC2=CC(=CC=C2)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H13N3O6/c24-20(15-10-17(22(25)26)12-18(11-15)23(27)28)29-19-8-4-5-14(9-19)13-21-16-6-2-1-3-7-16/h1-13H