5-[(2-nitro-4-oxidanyl-phenyl)amino]isoindole-1,3-dione

Systemtic Name: 5-[(2-nitro-4-oxidanyl-phenyl)amino]isoindole-1,3-dione Openeye Name: 5-(4-hydroxy-2-nitro-anilino)isoindoline-1,3-dione CAS Name: 5-(4-hydroxy-2-nitroanilino)isoindole-1,3-dione IUPAC Name: 5-(4-hydroxy-2-nitroanilino)isoindole-1,3-dione Traditional Name: 5-(4-hydroxy-2-nitro-anilino)isoindoline-1,3-quinone Formula: C14H9N3O5 MolecularWeight: 299.23836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC3=C(C=C(C=C3)O)[N+](=O)[O-])C(=O)NC2=O

Isomeric SMILES

C1=CC2=C(C=C1NC3=C(C=C(C=C3)O)[N+](=O)[O-])C(=O)NC2=O

InChI

InChI=1S/C14H9N3O5/c18-8-2-4-11(12(6-8)17(21)22)15-7-1-3-9-10(5-7)14(20)16-13(9)19/h1-6,15,18H,(H,16,19,20)