6-[[[4-(6-azanyl-1H-benzimidazol-2-yl)phenyl]amino]methylidene]-2,4-dinitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[4-(6-azanyl-1H-benzimidazol-2-yl)phenyl]amino]methylidene]-2,4-dinitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[4-(6-amino-1H-benzimidazol-2-yl)anilino]methylene]-2,4-dinitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[4-(6-amino-1H-benzimidazol-2-yl)anilino]methylidene]-2,4-dinitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[4-(6-amino-1H-benzimidazol-2-yl)anilino]methylidene]-2,4-dinitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[4-(6-amino-1H-benzimidazol-2-yl)anilino]methylene]-2,4-dinitro-cyclohexa-2,4-dien-1-one Formula: C20H14N6O5 MolecularWeight: 418.36236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(N2)C=C(C=C3)N)NC=C4C=C(C=C(C4=O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(N2)C=C(C=C3)N)NC=C4C=C(C=C(C4=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H14N6O5/c21-13-3-6-16-17(8-13)24-20(23-16)11-1-4-14(5-2-11)22-10-12-7-15(25(28)29)9-18(19(12)27)26(30)31/h1-10,22H,21H2,(H,23,24)