4-(4-chloranyl-3-methyl-phenyl)sulfonyl-4-methyl-pentan-2-one

Systemtic Name: 4-(4-chloranyl-3-methyl-phenyl)sulfonyl-4-methyl-pentan-2-one Openeye Name: 4-(4-chloro-3-methyl-phenyl)sulfonyl-4-methyl-pentan-2-one CAS Name: 4-(4-chloro-3-methylphenyl)sulfonyl-4-methyl-2-pentanone IUPAC Name: 4-(4-chloro-3-methylphenyl)sulfonyl-4-methylpentan-2-one Traditional Name: 4-(4-chloro-3-methyl-phenyl)sulfonyl-4-methyl-pentan-2-one Formula: C13H17ClO3S MolecularWeight: 288.79028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17ClO3S/c1-9-7-11(5-6-12(9)14)18(16,17)13(3,4)8-10(2)15/h5-7H,8H2,1-4H3