2-[3-(4-chlorophenyl)sulfanylpropanoylamino]ethanoate

Systemtic Name: 2-[3-(4-chlorophenyl)sulfanylpropanoylamino]ethanoate Openeye Name: 2-[3-(4-chlorophenyl)sulfanylpropanoylamino]acetate CAS Name: 2-[[3-[(4-chlorophenyl)thio]-1-oxopropyl]amino]acetate IUPAC Name: 2-[3-(4-chlorophenyl)sulfanylpropanoylamino]acetate Traditional Name: 2-[3-[(4-chlorophenyl)thio]propanoylamino]acetate Formula: C11H11ClNO3S- MolecularWeight: 272.72794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCCC(=O)NCC(=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1SCCC(=O)NCC(=O)[O-])Cl

InChI

InChI=1S/C11H12ClNO3S/c12-8-1-3-9(4-2-8)17-6-5-10(14)13-7-11(15)16/h1-4H,5-7H2,(H,13,14)(H,15,16)/p-1