ethyl 2-[4-(3-bromanylphenoxy)phenyl]-1-cyclohexyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 2-[4-(3-bromanylphenoxy)phenyl]-1-cyclohexyl-benzimidazole-5-carboxylate Openeye Name: ethyl 2-[4-(3-bromophenoxy)phenyl]-1-cyclohexyl-benzimidazole-5-carboxylate CAS Name: 2-[4-(3-bromophenoxy)phenyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-(3-bromophenoxy)phenyl]-1-cyclohexylbenzimidazole-5-carboxylate Traditional Name: 2-[4-(3-bromophenoxy)phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid ethyl ester Formula: C28H27BrN2O3 MolecularWeight: 519.42958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)C3=CC=C(C=C3)OC4=CC(=CC=C4)Br)C5CCCCC5

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)C3=CC=C(C=C3)OC4=CC(=CC=C4)Br)C5CCCCC5

InChI

InChI=1S/C28H27BrN2O3/c1-2-33-28(32)20-13-16-26-25(17-20)30-27(31(26)22-8-4-3-5-9-22)19-11-14-23(15-12-19)34-24-10-6-7-21(29)18-24/h6-7,10-18,22H,2-5,8-9H2,1H3