[2-[[5-methoxy-2-(3-methylbutyl)-6-oxidanyl-benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [2-[[5-methoxy-2-(3-methylbutyl)-6-oxidanyl-benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[(6-hydroxy-2-isopentyl-5-methoxy-benzimidazol-1-yl)methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[[6-hydroxy-5-methoxy-2-(3-methylbutyl)-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: [2-[[6-hydroxy-5-methoxy-2-(3-methylbutyl)benzimidazol-1-yl]methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[(6-hydroxy-2-isoamyl-5-methoxy-benzimidazol-1-yl)methyl]-6-phenyl-phenyl] ester Formula: C27H28N2O5 MolecularWeight: 460.52162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=NC2=CC(=C(C=C2N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)O)OC

Isomeric SMILES

CC(C)CCC1=NC2=CC(=C(C=C2N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)O)OC

InChI

InChI=1S/C27H28N2O5/c1-17(2)12-13-25-28-21-14-24(33-3)23(30)15-22(21)29(25)16-19-10-7-11-20(26(19)34-27(31)32)18-8-5-4-6-9-18/h4-11,14-15,17,30H,12-13,16H2,1-3H3,(H,31,32)