ethanoic acid; methylsulfinylbenzene

Systemtic Name: ethanoic acid; methylsulfinylbenzene Openeye Name: acetic acid; methylsulfinylbenzene CAS Name: acetic acid; methylsulfinylbenzene IUPAC Name: acetic acid; methylsulfinylbenzene Traditional Name: acetic acid; methylsulfinylbenzene Formula: C9H12O3S MolecularWeight: 200.25478

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.CS(=O)C1=CC=CC=C1

Isomeric SMILES

CC(=O)O.CS(=O)C1=CC=CC=C1

InChI

InChI=1S/C7H8OS.C2H4O2/c1-9(8)7-5-3-2-4-6-7;1-2(3)4/h2-6H,1H3;1H3,(H,3,4)