S-(2,2,4,4-tetramethyl-3-oxidanylidene-pentyl) 3-oxidanylbenzenecarbothioate

Systemtic Name: S-(2,2,4,4-tetramethyl-3-oxidanylidene-pentyl) 3-oxidanylbenzenecarbothioate Openeye Name: S-(2,2,4,4-tetramethyl-3-oxo-pentyl) 3-hydroxybenzenecarbothioate CAS Name: 3-hydroxybenzenecarbothioic acid S-(2,2,4,4-tetramethyl-3-oxopentyl) ester IUPAC Name: S-(2,2,4,4-tetramethyl-3-oxopentyl) 3-hydroxybenzenecarbothioate Traditional Name: 3-hydroxythiobenzoic acid S-(3-keto-2,2,4,4-tetramethyl-pentyl) ester Formula: C16H22O3S MolecularWeight: 294.40908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(C)(C)CSC(=O)C1=CC(=CC=C1)O

Isomeric SMILES

CC(C)(C)C(=O)C(C)(C)CSC(=O)C1=CC(=CC=C1)O

InChI

InChI=1S/C16H22O3S/c1-15(2,3)14(19)16(4,5)10-20-13(18)11-7-6-8-12(17)9-11/h6-9,17H,10H2,1-5H3