3-(3-oxidanylidenepropyl)benzenesulfonic acid

Systemtic Name: 3-(3-oxidanylidenepropyl)benzenesulfonic acid Openeye Name: 3-(3-oxopropyl)benzenesulfonic acid CAS Name: 3-(3-oxopropyl)benzenesulfonic acid IUPAC Name: 3-(3-oxopropyl)benzenesulfonic acid Traditional Name: 3-(3-ketopropyl)besylic acid Formula: C9H10O4S MolecularWeight: 214.2383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)O)CCC=O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)O)CCC=O

InChI

InChI=1S/C9H10O4S/c10-6-2-4-8-3-1-5-9(7-8)14(11,12)13/h1,3,5-7H,2,4H2,(H,11,12,13)