1,3-bis[bis[(1-ethylbenzimidazol-2-yl)methyl]amino]propan-2-ol; copper(1+); azide

Systemtic Name: 1,3-bis[bis[(1-ethylbenzimidazol-2-yl)methyl]amino]propan-2-ol; copper(1+); azide Openeye Name: dicuprous 1,3-bis[bis[(1-ethylbenzimidazol-2-yl)methyl]amino]propan-2-ol azide CAS Name: 1,3-bis[bis[(1-ethyl-2-benzimidazolyl)methyl]amino]-2-propanol; copper(1+); azide IUPAC Name: 1,3-bis[bis[(1-ethylbenzimidazol-2-yl)methyl]amino]propan-2-ol; copper(1+); azide Traditional Name: dicuprous 1,3-bis[bis[(1-ethylbenzimidazol-2-yl)methyl]amino]propan-2-ol azide Formula: C43H50Cu2N13O+ MolecularWeight: 892.0356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1CN(CC3=NC4=CC=CC=C4N3CC)CC(CN(CC5=NC6=CC=CC=C6N5CC)CC7=NC8=CC=CC=C8N7CC)O.[N-]=[N+]=[N-].[Cu+].[Cu+]

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1CN(CC3=NC4=CC=CC=C4N3CC)CC(CN(CC5=NC6=CC=CC=C6N5CC)CC7=NC8=CC=CC=C8N7CC)O.[N-]=[N+]=[N-].[Cu+].[Cu+]

InChI

InChI=1S/C43H50N10O.2Cu.N3/c1-5-50-36-21-13-9-17-32(36)44-40(50)27-48(28-41-45-33-18-10-14-22-37(33)51(41)6-2)25-31(54)26-49(29-42-46-34-19-11-15-23-38(34)52(42)7-3)30-43-47-35-20-12-16-24-39(35)53(43)8-4;;;1-3-2/h9-24,31,54H,5-8,25-30H2,1-4H3;;;/q;2*+1;-1