[2-[[2-(4-butoxyphenyl)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [2-[[2-(4-butoxyphenyl)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[[2-(4-butoxyphenyl)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[[2-(4-butoxyphenyl)-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: [2-[[2-(4-butoxyphenyl)benzimidazol-1-yl]methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[[2-(4-butoxyphenyl)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C31H28N2O4 MolecularWeight: 492.56502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3N2CC4=CC=CC(=C4OC(=O)O)C5=CC=CC=C5

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3N2CC4=CC=CC(=C4OC(=O)O)C5=CC=CC=C5

InChI

InChI=1S/C31H28N2O4/c1-2-3-20-36-25-18-16-23(17-19-25)30-32-27-14-7-8-15-28(27)33(30)21-24-12-9-13-26(29(24)37-31(34)35)22-10-5-4-6-11-22/h4-19H,2-3,20-21H2,1H3,(H,34,35)