4-[5-(6-piperazin-4-ium-1-yl-1H-benzimidazol-2-yl)-1,3-dihydrobenzimidazol-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5-(6-piperazin-4-ium-1-yl-1H-benzimidazol-2-yl)-1,3-dihydrobenzimidazol-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-(6-piperazin-4-ium-1-yl-1H-benzimidazol-2-yl)-1,3-dihydrobenzimidazol-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[5-[6-(1-piperazin-4-iumyl)-1H-benzimidazol-2-yl]-1,3-dihydrobenzimidazol-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5-(6-piperazin-4-ium-1-yl-1H-benzimidazol-2-yl)-1,3-dihydrobenzimidazol-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[5-(6-piperazin-4-ium-1-yl-1H-benzimidazol-2-yl)-1,3-dihydrobenzimidazol-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C24H23N6O+ MolecularWeight: 411.47902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=CC3=C(C=C2)N=C(N3)C4=CC5=C(C=C4)NC(=C6C=CC(=O)C=C6)N5

Isomeric SMILES

C1CN(CC[NH2+]1)C2=CC3=C(C=C2)N=C(N3)C4=CC5=C(C=C4)NC(=C6C=CC(=O)C=C6)N5

InChI

InChI=1S/C24H22N6O/c31-18-5-1-15(2-6-18)23-26-19-7-3-16(13-21(19)28-23)24-27-20-8-4-17(14-22(20)29-24)30-11-9-25-10-12-30/h1-8,13-14,25-26,28H,9-12H2,(H,27,29)/p+1