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

Systemtic Name: (2S)-2-[2-[(3-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: (2S)-2-[2-(3-chloroanilino)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: (2S)-2-[[2-(3-chloroanilino)-2-oxoethyl]thio]propanoic acid IUPAC Name: (2S)-2-[2-(3-chloroanilino)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: (2S)-2-[[2-(3-chloroanilino)-2-keto-ethyl]thio]propionic acid Formula: C11H12ClNO3S MolecularWeight: 273.73588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC(=O)NC1=CC(=CC=C1)Cl

Isomeric SMILES

C[C@@H](C(=O)O)SCC(=O)NC1=CC(=CC=C1)Cl

InChI

InChI=1S/C11H12ClNO3S/c1-7(11(15)16)17-6-10(14)13-9-4-2-3-8(12)5-9/h2-5,7H,6H2,1H3,(H,13,14)(H,15,16)/t7-/m0/s1