ethyl 4-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)sulfanyl]benzoate

Systemtic Name: ethyl 4-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)sulfanyl]benzoate Openeye Name: ethyl 4-(1,1,4,4,7-pentamethyltetralin-6-yl)sulfanylbenzoate CAS Name: 4-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)thio]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)sulfanyl]benzoate Traditional Name: 4-[(1,1,4,4,7-pentamethyltetralin-6-yl)thio]benzoic acid ethyl ester Formula: C24H30O2S MolecularWeight: 382.5588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)SC2=C(C=C3C(=C2)C(CCC3(C)C)(C)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)SC2=C(C=C3C(=C2)C(CCC3(C)C)(C)C)C

InChI

InChI=1S/C24H30O2S/c1-7-26-22(25)17-8-10-18(11-9-17)27-21-15-20-19(14-16(21)2)23(3,4)12-13-24(20,5)6/h8-11,14-15H,7,12-13H2,1-6H3