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

Systemtic Name: [4-(cyclohexyloxymethoxy)phenyl] 4-(2-phenylethynyl)benzoate Openeye Name: [4-(cyclohexoxymethoxy)phenyl] 4-(2-phenylethynyl)benzoate CAS Name: 4-(2-phenylethynyl)benzoic acid [4-(cyclohexyloxymethoxy)phenyl] ester IUPAC Name: [4-(cyclohexyloxymethoxy)phenyl] 4-(2-phenylethynyl)benzoate Traditional Name: 4-(2-phenylethynyl)benzoic acid [4-(cyclohexoxymethoxy)phenyl] ester Formula: C28H26O4 MolecularWeight: 426.50364

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OCOC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C#CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)OCOC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C#CC4=CC=CC=C4

InChI

InChI=1S/C28H26O4/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/h1,3-4,7-8,13-20,25H,2,5-6,9-10,21H2