6-chloranyl-4-methoxy-6-(4-methylphenyl)sulfonyl-hexan-2-one

Systemtic Name: 6-chloranyl-4-methoxy-6-(4-methylphenyl)sulfonyl-hexan-2-one Openeye Name: 6-chloro-4-methoxy-6-(p-tolylsulfonyl)hexan-2-one CAS Name: 6-chloro-4-methoxy-6-(4-methylphenyl)sulfonyl-2-hexanone IUPAC Name: 6-chloro-4-methoxy-6-(4-methylphenyl)sulfonylhexan-2-one Traditional Name: 6-chloro-4-methoxy-6-tosyl-hexan-2-one Formula: C14H19ClO4S MolecularWeight: 318.81626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CC(CC(=O)C)OC)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CC(CC(=O)C)OC)Cl

InChI

InChI=1S/C14H19ClO4S/c1-10-4-6-13(7-5-10)20(17,18)14(15)9-12(19-3)8-11(2)16/h4-7,12,14H,8-9H2,1-3H3