tert-butyl [2-[[2-butyl-7-[(propan-2-ylamino)methyl]benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate

Systemtic Name: tert-butyl [2-[[2-butyl-7-[(propan-2-ylamino)methyl]benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-[[2-butyl-7-[(isopropylamino)methyl]benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-[[2-butyl-7-[(propan-2-ylamino)methyl]-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-[[2-butyl-7-[(propan-2-ylamino)methyl]benzimidazol-1-yl]methyl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [2-[[2-butyl-7-[(isopropylamino)methyl]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=CC=CC(=C2N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)CNC(C)C

Isomeric SMILES

CCCCC1=NC2=CC=CC(=C2N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)CNC(C)C

InChI

InChI=1S/C33H41N3O3/c1-7-8-20-29-35-28-19-13-16-25(21-34-23(2)3)30(28)36(29)22-26-17-12-18-27(24-14-10-9-11-15-24)31(26)38-32(37)39-33(4,5)6/h9-19,23,34H,7-8,20-22H2,1-6H3