2-(2,4,6-triethylphenyl)carbonylsulfanylethanoic acid

Systemtic Name: 2-(2,4,6-triethylphenyl)carbonylsulfanylethanoic acid Openeye Name: 2-(2,4,6-triethylbenzoyl)sulfanylacetic acid CAS Name: 2-[[oxo-(2,4,6-triethylphenyl)methyl]thio]acetic acid IUPAC Name: 2-(2,4,6-triethylbenzoyl)sulfanylacetic acid Traditional Name: 2-[(2,4,6-triethylbenzoyl)thio]acetic acid Formula: C15H20O3S MolecularWeight: 280.3825

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1)CC)C(=O)SCC(=O)O)CC

Isomeric SMILES

CCC1=CC(=C(C(=C1)CC)C(=O)SCC(=O)O)CC

InChI

InChI=1S/C15H20O3S/c1-4-10-7-11(5-2)14(12(6-3)8-10)15(18)19-9-13(16)17/h7-8H,4-6,9H2,1-3H3,(H,16,17)