methyl 3-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-(trifluoromethyl)phenoxy]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-(trifluoromethyl)phenoxy]thiophene-2-carboxylate Openeye Name: methyl 3-[2-(1,3-dioxoisoindolin-2-yl)-4-(trifluoromethyl)phenoxy]thiophene-2-carboxylate CAS Name: 3-[2-(1,3-dioxo-2-isoindolyl)-4-(trifluoromethyl)phenoxy]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-(1,3-dioxoisoindol-2-yl)-4-(trifluoromethyl)phenoxy]thiophene-2-carboxylate Traditional Name: 3-[2-phthalimido-4-(trifluoromethyl)phenoxy]thiophene-2-carboxylic acid methyl ester Formula: C21H12F3NO5S MolecularWeight: 447.38389

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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)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COC(=O)C1=C(C=CS1)OC2=C(C=C(C=C2)C(F)(F)F)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H12F3NO5S/c1-29-20(28)17-16(8-9-31-17)30-15-7-6-11(21(22,23)24)10-14(15)25-18(26)12-4-2-3-5-13(12)19(25)27/h2-10H,1H3