S-tert-butyl 3-[4-(hydroxymethyl)phenyl]-3-oxidanyl-propanethioate

Systemtic Name: S-tert-butyl 3-[4-(hydroxymethyl)phenyl]-3-oxidanyl-propanethioate Openeye Name: S-tert-butyl 3-hydroxy-3-[4-(hydroxymethyl)phenyl]propanethioate CAS Name: 3-hydroxy-3-[4-(hydroxymethyl)phenyl]propanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl 3-hydroxy-3-[4-(hydroxymethyl)phenyl]propanethioate Traditional Name: 3-hydroxy-3-(4-methylolphenyl)propanethioic acid S-tert-butyl ester Formula: C14H20O3S MolecularWeight: 268.3718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC(=O)CC(C1=CC=C(C=C1)CO)O

Isomeric SMILES

CC(C)(C)SC(=O)CC(C1=CC=C(C=C1)CO)O

InChI

InChI=1S/C14H20O3S/c1-14(2,3)18-13(17)8-12(16)11-6-4-10(9-15)5-7-11/h4-7,12,15-16H,8-9H2,1-3H3