oxolan-2-ylmethyl 2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylethanoate

Systemtic Name: oxolan-2-ylmethyl 2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylethanoate Openeye Name: tetrahydrofuran-2-ylmethyl 2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetate CAS Name: 2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetic acid 2-oxolanylmethyl ester IUPAC Name: oxolan-2-ylmethyl 2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetate Traditional Name: 2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetic acid tetrahydrofurfuryl ester Formula: C14H14F3NO5S MolecularWeight: 365.32487

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)COC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H14F3NO5S/c15-14(16,17)9-3-4-12(11(6-9)18(20)21)24-8-13(19)23-7-10-2-1-5-22-10/h3-4,6,10H,1-2,5,7-8H2