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

Systemtic Name: [2-[[2-butyl-6-(phenethylcarbamoyl)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[[2-butyl-6-(phenethylcarbamoyl)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[[2-butyl-6-[oxo-(phenethylamino)methyl]-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: [2-[[2-butyl-6-(phenethylcarbamoyl)benzimidazol-1-yl]methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[[2-butyl-6-(phenethylcarbamoyl)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C34H33N3O4 MolecularWeight: 547.64352

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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)C(=O)NCCC5=CC=CC=C5

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)C=C(C=C2)C(=O)NCCC5=CC=CC=C5

InChI

InChI=1S/C34H33N3O4/c1-2-3-17-31-36-29-19-18-26(33(38)35-21-20-24-11-6-4-7-12-24)22-30(29)37(31)23-27-15-10-16-28(32(27)41-34(39)40)25-13-8-5-9-14-25/h4-16,18-19,22H,2-3,17,20-21,23H2,1H3,(H,35,38)(H,39,40)