2-[3-(2-chlorophenyl)sulfanylpropanoylamino]propanoic acid

Systemtic Name: 2-[3-(2-chlorophenyl)sulfanylpropanoylamino]propanoic acid Openeye Name: 2-[3-(2-chlorophenyl)sulfanylpropanoylamino]propanoic acid CAS Name: 2-[[3-[(2-chlorophenyl)thio]-1-oxopropyl]amino]propanoic acid IUPAC Name: 2-[3-(2-chlorophenyl)sulfanylpropanoylamino]propanoic acid Traditional Name: 2-[3-[(2-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)CCSC1=CC=CC=C1Cl

Isomeric SMILES

CC(C(=O)O)NC(=O)CCSC1=CC=CC=C1Cl

InChI

InChI=1S/C12H14ClNO3S/c1-8(12(16)17)14-11(15)6-7-18-10-5-3-2-4-9(10)13/h2-5,8H,6-7H2,1H3,(H,14,15)(H,16,17)