methyl (E)-N-methylsulfonyl-4-oxidanylidene-4-phenyl-2-(trifluoromethyl)but-2-enimidate

Systemtic Name: methyl (E)-N-methylsulfonyl-4-oxidanylidene-4-phenyl-2-(trifluoromethyl)but-2-enimidate Openeye Name: methyl (E)-N-methylsulfonyl-4-oxo-4-phenyl-2-(trifluoromethyl)but-2-enimidate CAS Name: (E)-N-methylsulfonyl-4-oxo-4-phenyl-2-(trifluoromethyl)-2-butenimidic acid methyl ester IUPAC Name: methyl (E)-N-methylsulfonyl-4-oxo-4-phenyl-2-(trifluoromethyl)but-2-enimidate Traditional Name: (E)-4-keto-N-mesyl-4-phenyl-2-(trifluoromethyl)but-2-enimidic acid methyl ester Formula: C13H12F3NO4S MolecularWeight: 335.29889

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Descriptors Computed from Structure

Canonical SMILES:

COC(=NS(=O)(=O)C)C(=CC(=O)C1=CC=CC=C1)C(F)(F)F

Isomeric SMILES

COC(=NS(=O)(=O)C)/C(=C\C(=O)C1=CC=CC=C1)/C(F)(F)F

InChI

InChI=1S/C13H12F3NO4S/c1-21-12(17-22(2,19)20)10(13(14,15)16)8-11(18)9-6-4-3-5-7-9/h3-8H,1-2H3/b10-8+,17-12?