tert-butyl 2-[3,4-bis(oxidanyl)phenyl]sulfanylethanoate

Systemtic Name: tert-butyl 2-[3,4-bis(oxidanyl)phenyl]sulfanylethanoate Openeye Name: tert-butyl 2-(3,4-dihydroxyphenyl)sulfanylacetate CAS Name: 2-[(3,4-dihydroxyphenyl)thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(3,4-dihydroxyphenyl)sulfanylacetate Traditional Name: 2-[(3,4-dihydroxyphenyl)thio]acetic acid tert-butyl ester Formula: C12H16O4S MolecularWeight: 256.31804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CSC1=CC(=C(C=C1)O)O

Isomeric SMILES

CC(C)(C)OC(=O)CSC1=CC(=C(C=C1)O)O

InChI

InChI=1S/C12H16O4S/c1-12(2,3)16-11(15)7-17-8-4-5-9(13)10(14)6-8/h4-6,13-14H,7H2,1-3H3