tert-butyl 2-[4-[[2-butyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]methyl]phenyl]benzoate

Systemtic Name: tert-butyl 2-[4-[[2-butyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]methyl]phenyl]benzoate Openeye Name: tert-butyl 2-[4-[[2-butyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]methyl]phenyl]benzoate CAS Name: 2-[4-[[2-butyl-6-(1-methyl-2-benzimidazolyl)-1-benzimidazolyl]methyl]phenyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[[2-butyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]methyl]phenyl]benzoate Traditional Name: 2-[4-[[2-butyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]methyl]phenyl]benzoic acid tert-butyl ester Formula: C37H38N4O2 MolecularWeight: 570.72322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC(C)(C)C)C=C(C=C2)C5=NC6=CC=CC=C6N5C

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC(C)(C)C)C=C(C=C2)C5=NC6=CC=CC=C6N5C

InChI

InChI=1S/C37H38N4O2/c1-6-7-16-34-38-31-22-21-27(35-39-30-14-10-11-15-32(30)40(35)5)23-33(31)41(34)24-25-17-19-26(20-18-25)28-12-8-9-13-29(28)36(42)43-37(2,3)4/h8-15,17-23H,6-7,16,24H2,1-5H3