cyclohexyl 6-(2-phenylethynyl)-1,2,3,4-tetrahydronaphthalene-2-carboxylate

Systemtic Name: cyclohexyl 6-(2-phenylethynyl)-1,2,3,4-tetrahydronaphthalene-2-carboxylate Openeye Name: cyclohexyl 6-(2-phenylethynyl)tetralin-2-carboxylate CAS Name: 6-(2-phenylethynyl)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 6-(2-phenylethynyl)-1,2,3,4-tetrahydronaphthalene-2-carboxylate Traditional Name: 6-(2-phenylethynyl)tetralin-2-carboxylic acid cyclohexyl ester Formula: C25H26O2 MolecularWeight: 358.47274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2CCC3=C(C2)C=CC(=C3)C#CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)OC(=O)C2CCC3=C(C2)C=CC(=C3)C#CC4=CC=CC=C4

InChI

InChI=1S/C25H26O2/c26-25(27-24-9-5-2-6-10-24)23-16-15-21-17-20(13-14-22(21)18-23)12-11-19-7-3-1-4-8-19/h1,3-4,7-8,13-14,17,23-24H,2,5-6,9-10,15-16,18H2