2-[3-(2-fluorophenyl)sulfanylpropanoylamino]hexanoic acid

Systemtic Name: 2-[3-(2-fluorophenyl)sulfanylpropanoylamino]hexanoic acid Openeye Name: 2-[3-(2-fluorophenyl)sulfanylpropanoylamino]hexanoic acid CAS Name: 2-[[3-[(2-fluorophenyl)thio]-1-oxopropyl]amino]hexanoic acid IUPAC Name: 2-[3-(2-fluorophenyl)sulfanylpropanoylamino]hexanoic acid Traditional Name: 2-[3-[(2-fluorophenyl)thio]propanoylamino]hexanoic acid Formula: C15H20FNO3S MolecularWeight: 313.387603

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)CCSC1=CC=CC=C1F

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)CCSC1=CC=CC=C1F

InChI

InChI=1S/C15H20FNO3S/c1-2-3-7-12(15(19)20)17-14(18)9-10-21-13-8-5-4-6-11(13)16/h4-6,8,12H,2-3,7,9-10H2,1H3,(H,17,18)(H,19,20)