[2-[[2-butyl-6-(phenylmethoxycarbonylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [2-[[2-butyl-6-(phenylmethoxycarbonylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[[6-(benzyloxycarbonylamino)-2-butyl-benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[[2-butyl-6-(phenylmethoxycarbonylamino)-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: [2-[[2-butyl-6-(phenylmethoxycarbonylamino)benzimidazol-1-yl]methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[[6-(benzyloxycarbonylamino)-2-butyl-benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C33H31N3O5 MolecularWeight: 549.61634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)C=C(C=C2)NC(=O)OCC5=CC=CC=C5

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)C=C(C=C2)NC(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C33H31N3O5/c1-2-3-17-30-35-28-19-18-26(34-32(37)40-22-23-11-6-4-7-12-23)20-29(28)36(30)21-25-15-10-16-27(31(25)41-33(38)39)24-13-8-5-9-14-24/h4-16,18-20H,2-3,17,21-22H2,1H3,(H,34,37)(H,38,39)