4-(cyclopropylmethoxy)-4-[1-(cyclopropylmethyl)-5-fluoranyl-benzimidazol-2-yl]-1-phenyl-cyclohexane-1-carboxylic acid

Systemtic Name: 4-(cyclopropylmethoxy)-4-[1-(cyclopropylmethyl)-5-fluoranyl-benzimidazol-2-yl]-1-phenyl-cyclohexane-1-carboxylic acid Openeye Name: 4-(cyclopropylmethoxy)-4-[1-(cyclopropylmethyl)-5-fluoro-benzimidazol-2-yl]-1-phenyl-cyclohexanecarboxylic acid CAS Name: 4-(cyclopropylmethoxy)-4-[1-(cyclopropylmethyl)-5-fluoro-2-benzimidazolyl]-1-phenyl-1-cyclohexanecarboxylic acid IUPAC Name: 4-(cyclopropylmethoxy)-4-[1-(cyclopropylmethyl)-5-fluorobenzimidazol-2-yl]-1-phenylcyclohexane-1-carboxylic acid Traditional Name: 4-(cyclopropylmethoxy)-4-[1-(cyclopropylmethyl)-5-fluoro-benzimidazol-2-yl]-1-phenyl-cyclohexanecarboxylic acid Formula: C28H31FN2O3 MolecularWeight: 462.555743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2C3=C(C=C(C=C3)F)N=C2C4(CCC(CC4)(C5=CC=CC=C5)C(=O)O)OCC6CC6

Isomeric SMILES

C1CC1CN2C3=C(C=C(C=C3)F)N=C2C4(CCC(CC4)(C5=CC=CC=C5)C(=O)O)OCC6CC6

InChI

InChI=1S/C28H31FN2O3/c29-22-10-11-24-23(16-22)30-25(31(24)17-19-6-7-19)28(34-18-20-8-9-20)14-12-27(13-15-28,26(32)33)21-4-2-1-3-5-21/h1-5,10-11,16,19-20H,6-9,12-15,17-18H2,(H,32,33)