3-phenyl-3-sulfanylidene-propanoic acid

Systemtic Name: 3-phenyl-3-sulfanylidene-propanoic acid Openeye Name: 3-phenyl-3-thioxo-propanoic acid CAS Name: 3-phenyl-3-sulfanylidenepropanoic acid IUPAC Name: 3-phenyl-3-sulfanylidenepropanoic acid Traditional Name: 3-phenyl-3-thioxo-propionic acid Formula: C9H8O2S MolecularWeight: 180.22362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8O2S/c10-9(11)6-8(12)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,11)