2-[2-(4-chlorophenyl)sulfanylpropanoylamino]propanoic acid

Systemtic Name: 2-[2-(4-chlorophenyl)sulfanylpropanoylamino]propanoic acid Openeye Name: 2-[2-(4-chlorophenyl)sulfanylpropanoylamino]propanoic acid CAS Name: 2-[[2-[(4-chlorophenyl)thio]-1-oxopropyl]amino]propanoic acid IUPAC Name: 2-[2-(4-chlorophenyl)sulfanylpropanoylamino]propanoic acid Traditional Name: 2-[2-[(4-chlorophenyl)thio]propanoylamino]propionic acid Formula: C12H14ClNO3S MolecularWeight: 287.76246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14ClNO3S/c1-7(12(16)17)14-11(15)8(2)18-10-5-3-9(13)4-6-10/h3-8H,1-2H3,(H,14,15)(H,16,17)