4-(butanoylamino)-3,5-dimethyl-benzenesulfonyl chloride

Systemtic Name: 4-(butanoylamino)-3,5-dimethyl-benzenesulfonyl chloride Openeye Name: 4-(butanoylamino)-3,5-dimethyl-benzenesulfonyl chloride CAS Name: 3,5-dimethyl-4-(1-oxobutylamino)benzenesulfonyl chloride IUPAC Name: 4-(butanoylamino)-3,5-dimethylbenzenesulfonyl chloride Traditional Name: 4-butyramido-3,5-dimethyl-benzenesulfonyl chloride Formula: C12H16ClNO3S MolecularWeight: 289.77834

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C=C(C=C1C)S(=O)(=O)Cl)C

Isomeric SMILES

CCCC(=O)NC1=C(C=C(C=C1C)S(=O)(=O)Cl)C

InChI

InChI=1S/C12H16ClNO3S/c1-4-5-11(15)14-12-8(2)6-10(7-9(12)3)18(13,16)17/h6-7H,4-5H2,1-3H3,(H,14,15)