[2-[[2-butyl-7-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [2-[[2-butyl-7-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[[2-butyl-7-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[[2-butyl-7-[[(cyclohexylamino)-oxomethyl]amino]-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: [2-[[2-butyl-7-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[[2-butyl-7-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C32H36N4O4 MolecularWeight: 540.65264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)C(=CC=C2)NC(=O)NC5CCCCC5

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)C(=CC=C2)NC(=O)NC5CCCCC5

InChI

InChI=1S/C32H36N4O4/c1-2-3-20-28-34-26-18-11-19-27(35-31(37)33-24-15-8-5-9-16-24)29(26)36(28)21-23-14-10-17-25(30(23)40-32(38)39)22-12-6-4-7-13-22/h4,6-7,10-14,17-19,24H,2-3,5,8-9,15-16,20-21H2,1H3,(H,38,39)(H2,33,35,37)