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

Systemtic Name: tert-butyl [2-[[2-butyl-6-(3-cyclohexylpiperidin-1-yl)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-[[2-butyl-6-(3-cyclohexyl-1-piperidyl)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-[[2-butyl-6-(3-cyclohexyl-1-piperidinyl)-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-[[2-butyl-6-(3-cyclohexylpiperidin-1-yl)benzimidazol-1-yl]methyl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [2-[[2-butyl-6-(3-cyclohexylpiperidino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C40H51N3O3 MolecularWeight: 621.85124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)C=C(C=C2)N5CCCC(C5)C6CCCCC6

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)C=C(C=C2)N5CCCC(C5)C6CCCCC6

InChI

InChI=1S/C40H51N3O3/c1-5-6-22-37-41-35-24-23-33(42-25-14-20-31(27-42)29-15-9-7-10-16-29)26-36(35)43(37)28-32-19-13-21-34(30-17-11-8-12-18-30)38(32)45-39(44)46-40(2,3)4/h8,11-13,17-19,21,23-24,26,29,31H,5-7,9-10,14-16,20,22,25,27-28H2,1-4H3