2-tert-butyl-4-methyl-6-sulfanyl-phenolate

Systemtic Name: 2-tert-butyl-4-methyl-6-sulfanyl-phenolate Openeye Name: 2-tert-butyl-4-methyl-6-sulfanyl-phenolate CAS Name: 2-tert-butyl-6-mercapto-4-methylphenolate IUPAC Name: 2-tert-butyl-4-methyl-6-sulfanylphenolate Traditional Name: 2-tert-butyl-6-mercapto-4-methyl-phenolate Formula: C11H15OS- MolecularWeight: 195.3012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16OS/c1-7-5-8(11(2,3)4)10(12)9(13)6-7/h5-6,12-13H,1-4H3/p-1