3-[(3,3-dimethylbutanoylamino)methyl]-4-methoxy-benzenesulfonyl chloride

Systemtic Name: 3-[(3,3-dimethylbutanoylamino)methyl]-4-methoxy-benzenesulfonyl chloride Openeye Name: 3-[(3,3-dimethylbutanoylamino)methyl]-4-methoxy-benzenesulfonyl chloride CAS Name: 3-[[(3,3-dimethyl-1-oxobutyl)amino]methyl]-4-methoxybenzenesulfonyl chloride IUPAC Name: 3-[(3,3-dimethylbutanoylamino)methyl]-4-methoxybenzenesulfonyl chloride Traditional Name: 3-[(3,3-dimethylbutanoylamino)methyl]-4-methoxy-benzenesulfonyl chloride Formula: C14H20ClNO4S MolecularWeight: 333.8309

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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