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

Systemtic Name: tert-butyl [2-[[2-butyl-6-(butylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-[[2-butyl-6-(butylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-[[2-butyl-6-(butylamino)-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-[[2-butyl-6-(butylamino)benzimidazol-1-yl]methyl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [2-[[2-butyl-6-(butylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C33H41N3O3 MolecularWeight: 527.69694

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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)NCCCC

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)C=C(C=C2)NCCCC

InChI

InChI=1S/C33H41N3O3/c1-6-8-18-30-35-28-20-19-26(34-21-9-7-2)22-29(28)36(30)23-25-16-13-17-27(24-14-11-10-12-15-24)31(25)38-32(37)39-33(3,4)5/h10-17,19-20,22,34H,6-9,18,21,23H2,1-5H3