5-chloranyl-4-methoxy-5-(phenylsulfonyl)pentan-2-one

Systemtic Name: 5-chloranyl-4-methoxy-5-(phenylsulfonyl)pentan-2-one Openeye Name: 5-(benzenesulfonyl)-5-chloro-4-methoxy-pentan-2-one CAS Name: 5-(benzenesulfonyl)-5-chloro-4-methoxy-2-pentanone IUPAC Name: 5-(benzenesulfonyl)-5-chloro-4-methoxypentan-2-one Traditional Name: 5-besyl-5-chloro-4-methoxy-pentan-2-one Formula: C12H15ClO4S MolecularWeight: 290.7631

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15ClO4S/c1-9(14)8-11(17-2)12(13)18(15,16)10-6-4-3-5-7-10/h3-7,11-12H,8H2,1-2H3