[2-[[2-chloranyl-6-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-thiophen-3-ylpropanoate

Systemtic Name: [2-[[2-chloranyl-6-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-thiophen-3-ylpropanoate Openeye Name: [2-[2-chloro-6-(trifluoromethyl)anilino]-2-oxo-ethyl] 3-(3-thienyl)propanoate CAS Name: 3-(3-thiophenyl)propanoic acid [2-[2-chloro-6-(trifluoromethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-chloro-6-(trifluoromethyl)anilino]-2-oxoethyl] 3-thiophen-3-ylpropanoate Traditional Name: 3-(3-thienyl)propionic acid [2-[2-chloro-6-(trifluoromethyl)anilino]-2-keto-ethyl] ester Formula: C16H13ClF3NO3S MolecularWeight: 391.79253

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)NC(=O)COC(=O)CCC2=CSC=C2)C(F)(F)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)NC(=O)COC(=O)CCC2=CSC=C2)C(F)(F)F

InChI

InChI=1S/C16H13ClF3NO3S/c17-12-3-1-2-11(16(18,19)20)15(12)21-13(22)8-24-14(23)5-4-10-6-7-25-9-10/h1-3,6-7,9H,4-5,8H2,(H,21,22)