3-[2-[2-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-[2-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-[2-(3-chlorophenyl)ethylamino]-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-[2-(3-chlorophenyl)ethylamino]-2-oxoethyl]thio]propanoic acid IUPAC Name: 3-[2-[2-(3-chlorophenyl)ethylamino]-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 3-[[2-[2-(3-chlorophenyl)ethylamino]-2-keto-ethyl]thio]propionic acid Formula: C13H16ClNO3S MolecularWeight: 301.78904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CCNC(=O)CSCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CCNC(=O)CSCCC(=O)O

InChI

InChI=1S/C13H16ClNO3S/c14-11-3-1-2-10(8-11)4-6-15-12(16)9-19-7-5-13(17)18/h1-3,8H,4-7,9H2,(H,15,16)(H,17,18)