ethyl 2-[[5-oxidanyl-5-(trichloromethyl)-4H-1,2-oxazol-3-yl]methylsulfanyl]ethanoate

Systemtic Name: ethyl 2-[[5-oxidanyl-5-(trichloromethyl)-4H-1,2-oxazol-3-yl]methylsulfanyl]ethanoate Openeye Name: ethyl 2-[[5-hydroxy-5-(trichloromethyl)-4H-isoxazol-3-yl]methylsulfanyl]acetate CAS Name: 2-[[5-hydroxy-5-(trichloromethyl)-4H-isoxazol-3-yl]methylthio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-hydroxy-5-(trichloromethyl)-4H-1,2-oxazol-3-yl]methylsulfanyl]acetate Traditional Name: 2-[[5-hydroxy-5-(trichloromethyl)-2-isoxazolin-3-yl]methylthio]acetic acid ethyl ester Formula: C9H12Cl3NO4S MolecularWeight: 336.61988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC1=NOC(C1)(C(Cl)(Cl)Cl)O

Isomeric SMILES

CCOC(=O)CSCC1=NOC(C1)(C(Cl)(Cl)Cl)O

InChI

InChI=1S/C9H12Cl3NO4S/c1-2-16-7(14)5-18-4-6-3-8(15,17-13-6)9(10,11)12/h15H,2-5H2,1H3