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

Systemtic Name: 3-ethyl-5-methyl-4-(2-methylpropanoylamino)benzenesulfonyl chloride Openeye Name: 3-ethyl-5-methyl-4-(2-methylpropanoylamino)benzenesulfonyl chloride CAS Name: 3-ethyl-5-methyl-4-[(2-methyl-1-oxopropyl)amino]benzenesulfonyl chloride IUPAC Name: 3-ethyl-5-methyl-4-(2-methylpropanoylamino)benzenesulfonyl chloride Traditional Name: 3-ethyl-4-(isobutyrylamino)-5-methyl-benzenesulfonyl chloride Formula: C13H18ClNO3S MolecularWeight: 303.80492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18ClNO3S/c1-5-10-7-11(19(14,17)18)6-9(4)12(10)15-13(16)8(2)3/h6-8H,5H2,1-4H3,(H,15,16)