methyl 2-azanylprop-2-enoate; trimethyl-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]azanium

Systemtic Name: methyl 2-azanylprop-2-enoate; trimethyl-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]azanium Openeye Name: methyl 2-aminoprop-2-enoate; trimethyl-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]ammonium CAS Name: 2-amino-2-propenoic acid methyl ester; trimethyl-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]ammonium IUPAC Name: methyl 2-aminoprop-2-enoate; trimethyl-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]azanium Traditional Name: 2-aminoacrylic acid methyl ester; trimethyl-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]ammonium Formula: C10H16F3N4O2S+ MolecularWeight: 313.31985

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=NC(=NS1)C(F)(F)F.COC(=O)C(=C)N

Isomeric SMILES

C[N+](C)(C)C1=NC(=NS1)C(F)(F)F.COC(=O)C(=C)N

InChI

InChI=1S/C6H9F3N3S.C4H7NO2/c1-12(2,3)5-10-4(11-13-5)6(7,8)9;1-3(5)4(6)7-2/h1-3H3;1,5H2,2H3/q+1;