3-chloranyl-4-(3,3-dimethylbutanoylamino)benzenesulfonyl chloride

Systemtic Name: 3-chloranyl-4-(3,3-dimethylbutanoylamino)benzenesulfonyl chloride Openeye Name: 3-chloro-4-(3,3-dimethylbutanoylamino)benzenesulfonyl chloride CAS Name: 3-chloro-4-[(3,3-dimethyl-1-oxobutyl)amino]benzenesulfonyl chloride IUPAC Name: 3-chloro-4-(3,3-dimethylbutanoylamino)benzenesulfonyl chloride Traditional Name: 3-chloro-4-(3,3-dimethylbutanoylamino)benzenesulfonyl chloride Formula: C12H15Cl2NO3S MolecularWeight: 324.2234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)Cl)Cl

Isomeric SMILES

CC(C)(C)CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)Cl)Cl

InChI

InChI=1S/C12H15Cl2NO3S/c1-12(2,3)7-11(16)15-10-5-4-8(6-9(10)13)19(14,17)18/h4-6H,7H2,1-3H3,(H,15,16)