phenyl 4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethynyl]benzoate

Systemtic Name: phenyl 4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethynyl]benzoate Openeye Name: phenyl 4-(2-tetralin-6-ylethynyl)benzoate CAS Name: 4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethynyl]benzoic acid phenyl ester IUPAC Name: phenyl 4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethynyl]benzoate Traditional Name: 4-(2-tetralin-6-ylethynyl)benzoic acid phenyl ester Formula: C25H20O2 MolecularWeight: 352.4251

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)C#CC3=CC=C(C=C3)C(=O)OC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)C#CC3=CC=C(C=C3)C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C25H20O2/c26-25(27-24-8-2-1-3-9-24)22-16-12-19(13-17-22)10-11-20-14-15-21-6-4-5-7-23(21)18-20/h1-3,8-9,12-18H,4-7H2