[2-[[2-butyl-6-(5-oxidanylidenepentanoylimino)-7H-benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [2-[[2-butyl-6-(5-oxidanylidenepentanoylimino)-7H-benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[[2-butyl-6-(5-oxopentanoylimino)-7H-benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[[2-butyl-6-(1,5-dioxopentylimino)-7H-benzimidazol-1-yl]methyl]-6-phenylphenyl] ester IUPAC Name: [2-[[2-butyl-6-(5-oxopentanoylimino)-7H-benzimidazol-1-yl]methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[[2-butyl-6-(5-ketopentanoylimino)-7H-benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C30H31N3O5 MolecularWeight: 513.58424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H31N3O5/c1-2-3-14-27-32-25-17-16-23(31-28(35)15-7-8-18-34)19-26(25)33(27)20-22-12-9-13-24(29(22)38-30(36)37)21-10-5-4-6-11-21/h4-6,9-13,16-18H,2-3,7-8,14-15,19-20H2,1H3,(H,36,37)