(E)-1,4-bis(1H-benzimidazol-2-yl)but-2-ene-1,4-dione

Systemtic Name: (E)-1,4-bis(1H-benzimidazol-2-yl)but-2-ene-1,4-dione Openeye Name: (E)-1,4-bis(1H-benzimidazol-2-yl)but-2-ene-1,4-dione CAS Name: (E)-1,4-bis(1H-benzimidazol-2-yl)-2-butene-1,4-dione IUPAC Name: (E)-1,4-bis(1H-benzimidazol-2-yl)but-2-ene-1,4-dione Traditional Name: (E)-1,4-bis(1H-benzimidazol-2-yl)but-2-ene-1,4-dione Formula: C18H12N4O2 MolecularWeight: 316.31348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C(=O)C=CC(=O)C3=NC4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)C(=O)/C=C/C(=O)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C18H12N4O2/c23-15(17-19-11-5-1-2-6-12(11)20-17)9-10-16(24)18-21-13-7-3-4-8-14(13)22-18/h1-10H,(H,19,20)(H,21,22)/b10-9+