2-[(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)methylsulfanylcarbonyl]benzoate

Systemtic Name: 2-[(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)methylsulfanylcarbonyl]benzoate Openeye Name: 2-[(1,1,4,4-tetramethyltetralin-6-yl)methylsulfanylcarbonyl]benzoate CAS Name: 2-[oxo-[(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)methylthio]methyl]benzoate IUPAC Name: 2-[(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)methylsulfanylcarbonyl]benzoate Traditional Name: 2-[(1,1,4,4-tetramethyltetralin-6-yl)methylthio]carbonylbenzoate Formula: C23H25O3S- MolecularWeight: 381.5078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=CC(=C2)CSC(=O)C3=CC=CC=C3C(=O)[O-])(C)C)C

Isomeric SMILES

CC1(CCC(C2=C1C=CC(=C2)CSC(=O)C3=CC=CC=C3C(=O)[O-])(C)C)C

InChI

InChI=1S/C23H26O3S/c1-22(2)11-12-23(3,4)19-13-15(9-10-18(19)22)14-27-21(26)17-8-6-5-7-16(17)20(24)25/h5-10,13H,11-12,14H2,1-4H3,(H,24,25)/p-1