[4-(cyclohexyloxymethoxy)cyclohexyl] 4-(2-phenylethynyl)benzoate

Systemtic Name: [4-(cyclohexyloxymethoxy)cyclohexyl] 4-(2-phenylethynyl)benzoate Openeye Name: [4-(cyclohexoxymethoxy)cyclohexyl] 4-(2-phenylethynyl)benzoate CAS Name: 4-(2-phenylethynyl)benzoic acid [4-(cyclohexyloxymethoxy)cyclohexyl] ester IUPAC Name: [4-(cyclohexyloxymethoxy)cyclohexyl] 4-(2-phenylethynyl)benzoate Traditional Name: 4-(2-phenylethynyl)benzoic acid [4-(cyclohexoxymethoxy)cyclohexyl] ester Formula: C28H32O4 MolecularWeight: 432.55128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OCOC2CCC(CC2)OC(=O)C3=CC=C(C=C3)C#CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)OCOC2CCC(CC2)OC(=O)C3=CC=C(C=C3)C#CC4=CC=CC=C4

InChI

InChI=1S/C28H32O4/c29-28(24-15-13-23(14-16-24)12-11-22-7-3-1-4-8-22)32-27-19-17-26(18-20-27)31-21-30-25-9-5-2-6-10-25/h1,3-4,7-8,13-16,25-27H,2,5-6,9-10,17-21H2