methyl 4-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)oct-1-ynyl]benzoate

Systemtic Name: methyl 4-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)oct-1-ynyl]benzoate Openeye Name: methyl 4-[3-(1,1,4,4-tetramethyltetralin-6-yl)oct-1-ynyl]benzoate CAS Name: 4-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)oct-1-ynyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)oct-1-ynyl]benzoate Traditional Name: 4-[3-(1,1,4,4-tetramethyltetralin-6-yl)oct-1-ynyl]benzoic acid methyl ester Formula: C30H38O2 MolecularWeight: 430.62152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C#CC1=CC=C(C=C1)C(=O)OC)C2=CC3=C(C=C2)C(CCC3(C)C)(C)C

Isomeric SMILES

CCCCCC(C#CC1=CC=C(C=C1)C(=O)OC)C2=CC3=C(C=C2)C(CCC3(C)C)(C)C

InChI

InChI=1S/C30H38O2/c1-7-8-9-10-23(14-11-22-12-15-24(16-13-22)28(31)32-6)25-17-18-26-27(21-25)30(4,5)20-19-29(26,2)3/h12-13,15-18,21,23H,7-10,19-20H2,1-6H3