6-[2-(4-chloranylsulfonyl-3,5-dimethyl-phenoxy)ethanoylamino]hexanoic acid

Systemtic Name: 6-[2-(4-chloranylsulfonyl-3,5-dimethyl-phenoxy)ethanoylamino]hexanoic acid Openeye Name: 6-[[2-(4-chlorosulfonyl-3,5-dimethyl-phenoxy)acetyl]amino]hexanoic acid CAS Name: 6-[[2-(4-chlorosulfonyl-3,5-dimethylphenoxy)-1-oxoethyl]amino]hexanoic acid IUPAC Name: 6-[[2-(4-chlorosulfonyl-3,5-dimethylphenoxy)acetyl]amino]hexanoic acid Traditional Name: 6-[[2-(4-chlorosulfonyl-3,5-dimethyl-phenoxy)acetyl]amino]hexanoic acid Formula: C16H22ClNO6S MolecularWeight: 391.86698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)Cl)C)OCC(=O)NCCCCCC(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)Cl)C)OCC(=O)NCCCCCC(=O)O

InChI

InChI=1S/C16H22ClNO6S/c1-11-8-13(9-12(2)16(11)25(17,22)23)24-10-14(19)18-7-5-3-4-6-15(20)21/h8-9H,3-7,10H2,1-2H3,(H,18,19)(H,20,21)