4-[(2-methylbutanoylamino)methyl]benzenesulfonyl chloride

Systemtic Name: 4-[(2-methylbutanoylamino)methyl]benzenesulfonyl chloride Openeye Name: 4-[(2-methylbutanoylamino)methyl]benzenesulfonyl chloride CAS Name: 4-[[(2-methyl-1-oxobutyl)amino]methyl]benzenesulfonyl chloride IUPAC Name: 4-[(2-methylbutanoylamino)methyl]benzenesulfonyl chloride Traditional Name: 4-[(2-methylbutanoylamino)methyl]benzenesulfonyl chloride Formula: C12H16ClNO3S MolecularWeight: 289.77834

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)NCC1=CC=C(C=C1)S(=O)(=O)Cl

Isomeric SMILES

CCC(C)C(=O)NCC1=CC=C(C=C1)S(=O)(=O)Cl

InChI

InChI=1S/C12H16ClNO3S/c1-3-9(2)12(15)14-8-10-4-6-11(7-5-10)18(13,16)17/h4-7,9H,3,8H2,1-2H3,(H,14,15)