3-ethyl-5-methyl-4-(2-methylbutanoylamino)benzenesulfonyl chloride

Systemtic Name: 3-ethyl-5-methyl-4-(2-methylbutanoylamino)benzenesulfonyl chloride Openeye Name: 3-ethyl-5-methyl-4-(2-methylbutanoylamino)benzenesulfonyl chloride CAS Name: 3-ethyl-5-methyl-4-[(2-methyl-1-oxobutyl)amino]benzenesulfonyl chloride IUPAC Name: 3-ethyl-5-methyl-4-(2-methylbutanoylamino)benzenesulfonyl chloride Traditional Name: 3-ethyl-5-methyl-4-(2-methylbutanoylamino)benzenesulfonyl chloride Formula: C14H20ClNO3S MolecularWeight: 317.8315

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)S(=O)(=O)Cl)C)NC(=O)C(C)CC

Isomeric SMILES

CCC1=C(C(=CC(=C1)S(=O)(=O)Cl)C)NC(=O)C(C)CC

InChI

InChI=1S/C14H20ClNO3S/c1-5-9(3)14(17)16-13-10(4)7-12(20(15,18)19)8-11(13)6-2/h7-9H,5-6H2,1-4H3,(H,16,17)