methyl 3-[2-nitro-4-(trifluoromethyl)phenoxy]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-nitro-4-(trifluoromethyl)phenoxy]thiophene-2-carboxylate Openeye Name: methyl 3-[2-nitro-4-(trifluoromethyl)phenoxy]thiophene-2-carboxylate CAS Name: 3-[2-nitro-4-(trifluoromethyl)phenoxy]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-nitro-4-(trifluoromethyl)phenoxy]thiophene-2-carboxylate Traditional Name: 3-[2-nitro-4-(trifluoromethyl)phenoxy]thiophene-2-carboxylic acid methyl ester Formula: C13H8F3NO5S MolecularWeight: 347.26653

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C=CS1)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H8F3NO5S/c1-21-12(18)11-10(4-5-23-11)22-9-3-2-7(13(14,15)16)6-8(9)17(19)20/h2-6H,1H3