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

Systemtic Name: 3-methyl-4-[(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbonylsulfanyl]benzoate Openeye Name: 3-methyl-4-(1,1,4,4-tetramethyltetralin-6-carbonyl)sulfanyl-benzoate CAS Name: 3-methyl-4-[[oxo-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)methyl]thio]benzoate IUPAC Name: 3-methyl-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbonyl)sulfanylbenzoate Traditional Name: 3-methyl-4-[(1,1,4,4-tetramethyltetralin-6-carbonyl)thio]benzoate Formula: C23H25O3S- MolecularWeight: 381.5078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)[O-])SC(=O)C2=CC3=C(C=C2)C(CCC3(C)C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)[O-])SC(=O)C2=CC3=C(C=C2)C(CCC3(C)C)(C)C

InChI

InChI=1S/C23H26O3S/c1-14-12-15(20(24)25)7-9-19(14)27-21(26)16-6-8-17-18(13-16)23(4,5)11-10-22(17,2)3/h6-9,12-13H,10-11H2,1-5H3,(H,24,25)/p-1