6-[2-(4-chlorophenyl)sulfanylpropanoylamino]hexanoic acid

Systemtic Name: 6-[2-(4-chlorophenyl)sulfanylpropanoylamino]hexanoic acid Openeye Name: 6-[2-(4-chlorophenyl)sulfanylpropanoylamino]hexanoic acid CAS Name: 6-[[2-[(4-chlorophenyl)thio]-1-oxopropyl]amino]hexanoic acid IUPAC Name: 6-[2-(4-chlorophenyl)sulfanylpropanoylamino]hexanoic acid Traditional Name: 6-[2-[(4-chlorophenyl)thio]propanoylamino]hexanoic acid Formula: C15H20ClNO3S MolecularWeight: 329.8422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCCCCC(=O)O)SC1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C(=O)NCCCCCC(=O)O)SC1=CC=C(C=C1)Cl

InChI

InChI=1S/C15H20ClNO3S/c1-11(21-13-8-6-12(16)7-9-13)15(20)17-10-4-2-3-5-14(18)19/h6-9,11H,2-5,10H2,1H3,(H,17,20)(H,18,19)