ethyl 2-[2-nitro-4-(trifluoromethyl)phenyl]sulfinylethanoate

Systemtic Name: ethyl 2-[2-nitro-4-(trifluoromethyl)phenyl]sulfinylethanoate Openeye Name: ethyl 2-[2-nitro-4-(trifluoromethyl)phenyl]sulfinylacetate CAS Name: 2-[2-nitro-4-(trifluoromethyl)phenyl]sulfinylacetic acid ethyl ester IUPAC Name: ethyl 2-[2-nitro-4-(trifluoromethyl)phenyl]sulfinylacetate Traditional Name: 2-[2-nitro-4-(trifluoromethyl)phenyl]sulfinylacetic acid ethyl ester Formula: C11H10F3NO5S MolecularWeight: 325.26101

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)C1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CS(=O)C1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C11H10F3NO5S/c1-2-20-10(16)6-21(19)9-4-3-7(11(12,13)14)5-8(9)15(17)18/h3-5H,2,6H2,1H3