3-tert-butylsulfanyl-2-tert-butylsulfonyl-benzoate

Systemtic Name: 3-tert-butylsulfanyl-2-tert-butylsulfonyl-benzoate Openeye Name: 3-tert-butylsulfanyl-2-tert-butylsulfonyl-benzoate CAS Name: 2-tert-butylsulfonyl-3-(tert-butylthio)benzoate IUPAC Name: 3-tert-butylsulfanyl-2-tert-butylsulfonylbenzoate Traditional Name: 2-tert-butylsulfonyl-3-(tert-butylthio)benzoate Formula: C15H21O4S2- MolecularWeight: 329.45484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC1=CC=CC(=C1S(=O)(=O)C(C)(C)C)C(=O)[O-]

Isomeric SMILES

CC(C)(C)SC1=CC=CC(=C1S(=O)(=O)C(C)(C)C)C(=O)[O-]

InChI

InChI=1S/C15H22O4S2/c1-14(2,3)20-11-9-7-8-10(13(16)17)12(11)21(18,19)15(4,5)6/h7-9H,1-6H3,(H,16,17)/p-1