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

Systemtic Name: tert-butyl [2-[[2-butyl-6-(hexoxycarbonylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-[[2-butyl-6-(hexoxycarbonylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-[[2-butyl-6-[[hexoxy(oxo)methyl]amino]-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-[[2-butyl-6-(hexoxycarbonylamino)benzimidazol-1-yl]methyl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [2-[[2-butyl-6-(hexoxycarbonylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C36H45N3O5 MolecularWeight: 599.7596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)NC1=CC2=C(C=C1)N=C(N2CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)CCCC

Isomeric SMILES

CCCCCCOC(=O)NC1=CC2=C(C=C1)N=C(N2CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)CCCC

InChI

InChI=1S/C36H45N3O5/c1-6-8-10-14-23-42-34(40)37-28-21-22-30-31(24-28)39(32(38-30)20-9-7-2)25-27-18-15-19-29(26-16-12-11-13-17-26)33(27)43-35(41)44-36(3,4)5/h11-13,15-19,21-22,24H,6-10,14,20,23,25H2,1-5H3,(H,37,40)