2-(2-tert-butylsulfonyl-3,5-dimethyl-phenyl)ethanoate

Systemtic Name: 2-(2-tert-butylsulfonyl-3,5-dimethyl-phenyl)ethanoate Openeye Name: 2-(2-tert-butylsulfonyl-3,5-dimethyl-phenyl)acetate CAS Name: 2-(2-tert-butylsulfonyl-3,5-dimethylphenyl)acetate IUPAC Name: 2-(2-tert-butylsulfonyl-3,5-dimethylphenyl)acetate Traditional Name: 2-(2-tert-butylsulfonyl-3,5-dimethyl-phenyl)acetate Formula: C14H19O4S- MolecularWeight: 283.36326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)CC(=O)[O-])S(=O)(=O)C(C)(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)CC(=O)[O-])S(=O)(=O)C(C)(C)C)C

InChI

InChI=1S/C14H20O4S/c1-9-6-10(2)13(11(7-9)8-12(15)16)19(17,18)14(3,4)5/h6-7H,8H2,1-5H3,(H,15,16)/p-1