ethyl 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylphenoxy]propanoate

Systemtic Name: ethyl 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylphenoxy]propanoate Openeye Name: ethyl 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylphenoxy]propanoate CAS Name: 2-[4-[[2-nitro-4-(trifluoromethyl)phenyl]thio]phenoxy]propanoic acid ethyl ester IUPAC Name: ethyl 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylphenoxy]propanoate Traditional Name: 2-[4-[[2-nitro-4-(trifluoromethyl)phenyl]thio]phenoxy]propionic acid ethyl ester Formula: C18H16F3NO5S MolecularWeight: 415.38355

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(C)OC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H16F3NO5S/c1-3-26-17(23)11(2)27-13-5-7-14(8-6-13)28-16-9-4-12(18(19,20)21)10-15(16)22(24)25/h4-11H,3H2,1-2H3