5,5-bis(chloranyl)-4-methoxy-5-(phenylsulfinyl)pentan-2-one

Systemtic Name: 5,5-bis(chloranyl)-4-methoxy-5-(phenylsulfinyl)pentan-2-one Openeye Name: 5-(benzenesulfinyl)-5,5-dichloro-4-methoxy-pentan-2-one CAS Name: 5-(benzenesulfinyl)-5,5-dichloro-4-methoxy-2-pentanone IUPAC Name: 5-(benzenesulfinyl)-5,5-dichloro-4-methoxypentan-2-one Traditional Name: 5-(benzenesulfinyl)-5,5-dichloro-4-methoxy-pentan-2-one Formula: C12H14Cl2O3S MolecularWeight: 309.20876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14Cl2O3S/c1-9(15)8-11(17-2)12(13,14)18(16)10-6-4-3-5-7-10/h3-7,11H,8H2,1-2H3