2-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 2-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 2-[2-(3-chloro-4-fluoro-anilino)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 2-[[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-[[2-(3-chloro-4-fluoro-anilino)-2-keto-ethyl]thio]propionic acid Formula: C11H11ClFNO3S MolecularWeight: 291.726343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11ClFNO3S/c1-6(11(16)17)18-5-10(15)14-7-2-3-9(13)8(12)4-7/h2-4,6H,5H2,1H3,(H,14,15)(H,16,17)