ethyl 2-[2-[[2-chloranyl-4-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-[[2-chloranyl-4-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-[2-chloro-4-(trifluoromethyl)anilino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[2-chloro-4-(trifluoromethyl)anilino]-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-chloro-4-(trifluoromethyl)anilino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-[2-chloro-4-(trifluoromethyl)anilino]-2-keto-ethyl]thio]acetic acid ethyl ester Formula: C13H13ClF3NO3S MolecularWeight: 355.76043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)NC1=C(C=C(C=C1)C(F)(F)F)Cl

Isomeric SMILES

CCOC(=O)CSCC(=O)NC1=C(C=C(C=C1)C(F)(F)F)Cl

InChI

InChI=1S/C13H13ClF3NO3S/c1-2-21-12(20)7-22-6-11(19)18-10-4-3-8(5-9(10)14)13(15,16)17/h3-5H,2,6-7H2,1H3,(H,18,19)