methyl 2-[2-[(Z)-[3-methyl-4-(trifluoromethyl)-1,2,3-thiadiazol-2-ium-2-ylidene]methyl]phenyl]ethanoate

Systemtic Name: methyl 2-[2-[(Z)-[3-methyl-4-(trifluoromethyl)-1,2,3-thiadiazol-2-ium-2-ylidene]methyl]phenyl]ethanoate Openeye Name: methyl 2-[2-[(Z)-[3-methyl-4-(trifluoromethyl)thiadiazol-2-ium-2-ylidene]methyl]phenyl]acetate CAS Name: 2-[2-[(Z)-[3-methyl-4-(trifluoromethyl)-2-thiadiazol-2-iumylidene]methyl]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(Z)-[3-methyl-4-(trifluoromethyl)thiadiazol-2-ium-2-ylidene]methyl]phenyl]acetate Traditional Name: 2-[2-[(Z)-[3-methyl-4-(trifluoromethyl)thiadiazol-2-ium-2-ylidene]methyl]phenyl]acetic acid methyl ester Formula: C14H14F3N2O2S+ MolecularWeight: 331.33337

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CS[N+]1=CC2=CC=CC=C2CC(=O)OC)C(F)(F)F

Isomeric SMILES

CN\1C(=CS/[N+]1=C\C2=CC=CC=C2CC(=O)OC)C(F)(F)F

InChI

InChI=1S/C14H14F3N2O2S/c1-18-12(14(15,16)17)9-22-19(18)8-11-6-4-3-5-10(11)7-13(20)21-2/h3-6,8-9H,7H2,1-2H3/q+1/b19-8-