tert-butyl [3-[2-butyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate

Systemtic Name: tert-butyl [3-[2-butyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [3-[2-butyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [3-[2-butyl-6-(1-methyl-2-benzimidazolyl)-1-benzimidazolyl]-2-methyl-6-phenylphenyl] ester IUPAC Name: tert-butyl [3-[2-butyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]-2-methyl-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [3-[2-butyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] ester Formula: C37H38N4O3 MolecularWeight: 586.72262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)OC(C)(C)C)C)C=C(C=C2)C5=NC6=CC=CC=C6N5C

Isomeric SMILES

CCCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)OC(C)(C)C)C)C=C(C=C2)C5=NC6=CC=CC=C6N5C

InChI

InChI=1S/C37H38N4O3/c1-7-8-18-33-38-29-21-19-26(35-39-28-16-12-13-17-31(28)40(35)6)23-32(29)41(33)30-22-20-27(25-14-10-9-11-15-25)34(24(30)2)43-36(42)44-37(3,4)5/h9-17,19-23H,7-8,18H2,1-6H3