1-(2-chloranyl-4-methylsulfonyl-phenyl)-2-(3-methyl-1,2,4-oxadiazol-5-yl)butane-1,3-dione

Systemtic Name: 1-(2-chloranyl-4-methylsulfonyl-phenyl)-2-(3-methyl-1,2,4-oxadiazol-5-yl)butane-1,3-dione Openeye Name: 1-(2-chloro-4-methylsulfonyl-phenyl)-2-(3-methyl-1,2,4-oxadiazol-5-yl)butane-1,3-dione CAS Name: 1-(2-chloro-4-methylsulfonylphenyl)-2-(3-methyl-1,2,4-oxadiazol-5-yl)butane-1,3-dione IUPAC Name: 1-(2-chloro-4-methylsulfonylphenyl)-2-(3-methyl-1,2,4-oxadiazol-5-yl)butane-1,3-dione Traditional Name: 1-(2-chloro-4-mesyl-phenyl)-2-(3-methyl-1,2,4-oxadiazol-5-yl)butane-1,3-dione Formula: C14H13ClN2O5S MolecularWeight: 356.78142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)C(C(=O)C)C(=O)C2=C(C=C(C=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=NOC(=N1)C(C(=O)C)C(=O)C2=C(C=C(C=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C14H13ClN2O5S/c1-7(18)12(14-16-8(2)17-22-14)13(19)10-5-4-9(6-11(10)15)23(3,20)21/h4-6,12H,1-3H3