5-nitro-2-(4-nitrophenyl)isoindole-1,3-dione

Systemtic Name: 5-nitro-2-(4-nitrophenyl)isoindole-1,3-dione Openeye Name: 5-nitro-2-(4-nitrophenyl)isoindoline-1,3-dione CAS Name: 5-nitro-2-(4-nitrophenyl)isoindole-1,3-dione IUPAC Name: 5-nitro-2-(4-nitrophenyl)isoindole-1,3-dione Traditional Name: 5-nitro-2-(4-nitrophenyl)isoindoline-1,3-quinone Formula: C14H7N3O6 MolecularWeight: 313.22188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H7N3O6/c18-13-11-6-5-10(17(22)23)7-12(11)14(19)15(13)8-1-3-9(4-2-8)16(20)21/h1-7H