tert-butyl [2-[[6-(1-butylbenzimidazol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate

Systemtic Name: tert-butyl [2-[[6-(1-butylbenzimidazol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-[[6-(1-butylbenzimidazol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-[[6-(1-butyl-2-benzimidazolyl)-2-propyl-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-[[6-(1-butylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [2-[[6-(1-butylbenzimidazol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C39H42N4O3 MolecularWeight: 614.77578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2N=C1C3=CC4=C(C=C3)N=C(N4CC5=CC=CC(=C5OC(=O)OC(C)(C)C)C6=CC=CC=C6)CCC

Isomeric SMILES

CCCCN1C2=CC=CC=C2N=C1C3=CC4=C(C=C3)N=C(N4CC5=CC=CC(=C5OC(=O)OC(C)(C)C)C6=CC=CC=C6)CCC

InChI

InChI=1S/C39H42N4O3/c1-6-8-24-42-33-21-13-12-20-31(33)41-37(42)28-22-23-32-34(25-28)43(35(40-32)15-7-2)26-29-18-14-19-30(27-16-10-9-11-17-27)36(29)45-38(44)46-39(3,4)5/h9-14,16-23,25H,6-8,15,24,26H2,1-5H3