[2-[(2-butyl-7-methoxy-4-methyl-benzimidazol-1-yl)methyl]-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [2-[(2-butyl-7-methoxy-4-methyl-benzimidazol-1-yl)methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[(2-butyl-7-methoxy-4-methyl-benzimidazol-1-yl)methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[(2-butyl-7-methoxy-4-methyl-1-benzimidazolyl)methyl]-6-phenylphenyl] ester IUPAC Name: [2-[(2-butyl-7-methoxy-4-methylbenzimidazol-1-yl)methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[(2-butyl-7-methoxy-4-methyl-benzimidazol-1-yl)methyl]-6-phenyl-phenyl] ester Formula: C27H28N2O4 MolecularWeight: 444.52222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C=CC(=C2N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)OC)C

Isomeric SMILES

CCCCC1=NC2=C(C=CC(=C2N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)OC)C

InChI

InChI=1S/C27H28N2O4/c1-4-5-14-23-28-24-18(2)15-16-22(32-3)25(24)29(23)17-20-12-9-13-21(26(20)33-27(30)31)19-10-7-6-8-11-19/h6-13,15-16H,4-5,14,17H2,1-3H3,(H,30,31)