2-[4-[[2-butyl-6-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]phenoxy]-2-phenyl-ethanoic acid

Systemtic Name: 2-[4-[[2-butyl-6-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]phenoxy]-2-phenyl-ethanoic acid Openeye Name: 2-[4-[[2-butyl-6-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]phenoxy]-2-phenyl-acetic acid CAS Name: 2-[4-[[2-butyl-6-[[(cyclohexylamino)-oxomethyl]amino]-1-benzimidazolyl]methyl]phenoxy]-2-phenylacetic acid IUPAC Name: 2-[4-[[2-butyl-6-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]phenoxy]-2-phenylacetic acid Traditional Name: 2-[4-[[2-butyl-6-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]phenoxy]-2-phenyl-acetic acid Formula: C33H38N4O4 MolecularWeight: 554.67922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)OC(C4=CC=CC=C4)C(=O)O)C=C(C=C2)NC(=O)NC5CCCCC5

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)OC(C4=CC=CC=C4)C(=O)O)C=C(C=C2)NC(=O)NC5CCCCC5

InChI

InChI=1S/C33H38N4O4/c1-2-3-14-30-36-28-20-17-26(35-33(40)34-25-12-8-5-9-13-25)21-29(28)37(30)22-23-15-18-27(19-16-23)41-31(32(38)39)24-10-6-4-7-11-24/h4,6-7,10-11,15-21,25,31H,2-3,5,8-9,12-14,22H2,1H3,(H,38,39)(H2,34,35,40)