3-phenyl-5-sulfanylidene-pentanoic acid

Systemtic Name: 3-phenyl-5-sulfanylidene-pentanoic acid Openeye Name: 3-phenyl-5-thioxo-pentanoic acid CAS Name: 3-phenyl-5-sulfanylidenepentanoic acid IUPAC Name: 3-phenyl-5-sulfanylidenepentanoic acid Traditional Name: 3-phenyl-5-thioxo-valeric acid Formula: C11H12O2S MolecularWeight: 208.27678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12O2S/c12-11(13)8-10(6-7-14)9-4-2-1-3-5-9/h1-5,7,10H,6,8H2,(H,12,13)