2-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-sulfanyl-ethanoic acid

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-sulfanyl-ethanoic acid Openeye Name: 2-(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-2-sulfanyl-acetic acid CAS Name: 2-(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)-2-mercaptoacetic acid IUPAC Name: 2-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-2-sulfanylacetic acid Traditional Name: 2-(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)-2-mercapto-acetic acid Formula: C16H22O3S MolecularWeight: 294.40908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=O)O)S)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=O)O)S)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C16H22O3S/c1-15(2,3)10-7-9(13(20)14(18)19)8-11(12(10)17)16(4,5)6/h7-8,20H,1-6H3,(H,18,19)