methyl 3-ethanoylbenzenesulfinate

Systemtic Name: methyl 3-ethanoylbenzenesulfinate Openeye Name: methyl 3-acetylbenzenesulfinate CAS Name: 3-acetylbenzenesulfinic acid methyl ester IUPAC Name: methyl 3-acetylbenzenesulfinate Traditional Name: 3-acetylbenzenesulfinic acid methyl ester Formula: C9H10O3S MolecularWeight: 198.2389

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)OC

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)OC

InChI

InChI=1S/C9H10O3S/c1-7(10)8-4-3-5-9(6-8)13(11)12-2/h3-6H,1-2H3