4-[2-(3-methylbutanoylamino)ethyl]benzenesulfonyl chloride

Systemtic Name: 4-[2-(3-methylbutanoylamino)ethyl]benzenesulfonyl chloride Openeye Name: 4-[2-(3-methylbutanoylamino)ethyl]benzenesulfonyl chloride CAS Name: 4-[2-[(3-methyl-1-oxobutyl)amino]ethyl]benzenesulfonyl chloride IUPAC Name: 4-[2-(3-methylbutanoylamino)ethyl]benzenesulfonyl chloride Traditional Name: 4-[2-(isovalerylamino)ethyl]benzenesulfonyl chloride Formula: C13H18ClNO3S MolecularWeight: 303.80492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NCCC1=CC=C(C=C1)S(=O)(=O)Cl

Isomeric SMILES

CC(C)CC(=O)NCCC1=CC=C(C=C1)S(=O)(=O)Cl

InChI

InChI=1S/C13H18ClNO3S/c1-10(2)9-13(16)15-8-7-11-3-5-12(6-4-11)19(14,17)18/h3-6,10H,7-9H2,1-2H3,(H,15,16)