(6E)-6-[(1H-benzimidazol-2-ylamino)methylidene]-2,4-dinitro-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[(1H-benzimidazol-2-ylamino)methylidene]-2,4-dinitro-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[(1H-benzimidazol-2-ylamino)methylene]-2,4-dinitro-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[(1H-benzimidazol-2-ylamino)methylidene]-2,4-dinitro-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[(1H-benzimidazol-2-ylamino)methylidene]-2,4-dinitrocyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[(1H-benzimidazol-2-ylamino)methylene]-2,4-dinitro-cyclohexa-2,4-dien-1-one Formula: C14H9N5O5 MolecularWeight: 327.25176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)N/C=C/3\C=C(C=C(C3=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H9N5O5/c20-13-8(5-9(18(21)22)6-12(13)19(23)24)7-15-14-16-10-3-1-2-4-11(10)17-14/h1-7H,(H2,15,16,17)/b8-7+