2-methyl-4-phenyl-4-sulfanylidene-butanoic acid

Systemtic Name: 2-methyl-4-phenyl-4-sulfanylidene-butanoic acid Openeye Name: 2-methyl-4-phenyl-4-thioxo-butanoic acid CAS Name: 2-methyl-4-phenyl-4-sulfanylidenebutanoic acid IUPAC Name: 2-methyl-4-phenyl-4-sulfanylidenebutanoic acid Traditional Name: 2-methyl-4-phenyl-4-thioxo-butyric acid Formula: C11H12O2S MolecularWeight: 208.27678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12O2S/c1-8(11(12)13)7-10(14)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,12,13)