ethyl 4-[2-(8,8-dimethyl-5-pentan-3-ylidene-6,7-dihydronaphthalen-2-yl)ethynyl]benzoate

Systemtic Name: ethyl 4-[2-(8,8-dimethyl-5-pentan-3-ylidene-6,7-dihydronaphthalen-2-yl)ethynyl]benzoate Openeye Name: ethyl 4-[2-[1-(1-ethylpropylidene)-4,4-dimethyl-tetralin-6-yl]ethynyl]benzoate CAS Name: 4-[2-(8,8-dimethyl-5-pentan-3-ylidene-6,7-dihydronaphthalen-2-yl)ethynyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(8,8-dimethyl-5-pentan-3-ylidene-6,7-dihydronaphthalen-2-yl)ethynyl]benzoate Traditional Name: 4-[2-[1-(1-ethylpropylidene)-4,4-dimethyl-tetralin-6-yl]ethynyl]benzoic acid ethyl ester Formula: C28H32O2 MolecularWeight: 400.55248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1CCC(C2=C1C=CC(=C2)C#CC3=CC=C(C=C3)C(=O)OCC)(C)C)CC

Isomeric SMILES

CCC(=C1CCC(C2=C1C=CC(=C2)C#CC3=CC=C(C=C3)C(=O)OCC)(C)C)CC

InChI

InChI=1S/C28H32O2/c1-6-22(7-2)24-17-18-28(4,5)26-19-21(13-16-25(24)26)10-9-20-11-14-23(15-12-20)27(29)30-8-3/h11-16,19H,6-8,17-18H2,1-5H3