ethanoic acid; 1-(4-sulfanylphenyl)ethanone

Systemtic Name: ethanoic acid; 1-(4-sulfanylphenyl)ethanone Openeye Name: acetic acid; 1-(4-sulfanylphenyl)ethanone CAS Name: acetic acid; 1-(4-mercaptophenyl)ethanone IUPAC Name: acetic acid; 1-(4-sulfanylphenyl)ethanone Traditional Name: acetic acid; 1-(4-mercaptophenyl)ethanone Formula: C10H12O3S MolecularWeight: 212.26548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H8OS.C2H4O2/c1-6(9)7-2-4-8(10)5-3-7;1-2(3)4/h2-5,10H,1H3;1H3,(H,3,4)