2,2-dimethyl-7-[4-[1-(phenylmethyl)benzimidazol-2-yl]phenoxy]heptanoic acid

Systemtic Name: 2,2-dimethyl-7-[4-[1-(phenylmethyl)benzimidazol-2-yl]phenoxy]heptanoic acid Openeye Name: 7-[4-(1-benzylbenzimidazol-2-yl)phenoxy]-2,2-dimethyl-heptanoic acid CAS Name: 2,2-dimethyl-7-[4-[1-(phenylmethyl)-2-benzimidazolyl]phenoxy]heptanoic acid IUPAC Name: 7-[4-(1-benzylbenzimidazol-2-yl)phenoxy]-2,2-dimethylheptanoic acid Traditional Name: 7-[4-(1-benzylbenzimidazol-2-yl)phenoxy]-2,2-dimethyl-enanthic acid Formula: C29H32N2O3 MolecularWeight: 456.57598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3N2CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC(C)(CCCCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3N2CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C29H32N2O3/c1-29(2,28(32)33)19-9-4-10-20-34-24-17-15-23(16-18-24)27-30-25-13-7-8-14-26(25)31(27)21-22-11-5-3-6-12-22/h3,5-8,11-18H,4,9-10,19-21H2,1-2H3,(H,32,33)