tert-butyl [2-[[2-butyl-5-(pentylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate

Systemtic Name: tert-butyl [2-[[2-butyl-5-(pentylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-[[2-butyl-5-(pentylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-[[2-butyl-5-(pentylamino)-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-[[2-butyl-5-(pentylamino)benzimidazol-1-yl]methyl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid [2-[[5-(amylamino)-2-butyl-benzimidazol-1-yl]methyl]-6-phenyl-phenyl] tert-butyl ester Formula: C34H43N3O3 MolecularWeight: 541.72352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=CC2=C(C=C1)N(C(=N2)CCCC)CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4

Isomeric SMILES

CCCCCNC1=CC2=C(C=C1)N(C(=N2)CCCC)CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4

InChI

InChI=1S/C34H43N3O3/c1-6-8-13-22-35-27-20-21-30-29(23-27)36-31(19-9-7-2)37(30)24-26-17-14-18-28(25-15-11-10-12-16-25)32(26)39-33(38)40-34(3,4)5/h10-12,14-18,20-21,23,35H,6-9,13,19,22,24H2,1-5H3