5-[(3,3-dimethylbutanoylamino)methyl]-2-methoxy-benzenesulfonyl chloride

Systemtic Name: 5-[(3,3-dimethylbutanoylamino)methyl]-2-methoxy-benzenesulfonyl chloride Openeye Name: 5-[(3,3-dimethylbutanoylamino)methyl]-2-methoxy-benzenesulfonyl chloride CAS Name: 5-[[(3,3-dimethyl-1-oxobutyl)amino]methyl]-2-methoxybenzenesulfonyl chloride IUPAC Name: 5-[(3,3-dimethylbutanoylamino)methyl]-2-methoxybenzenesulfonyl chloride Traditional Name: 5-[(3,3-dimethylbutanoylamino)methyl]-2-methoxy-benzenesulfonyl chloride Formula: C14H20ClNO4S MolecularWeight: 333.8309

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20ClNO4S/c1-14(2,3)8-13(17)16-9-10-5-6-11(20-4)12(7-10)21(15,18)19/h5-7H,8-9H2,1-4H3,(H,16,17)