(E)-4-oxidanylidene-4-[2-(trifluoromethyl)phenoxy]but-2-enoate; urea

Systemtic Name: (E)-4-oxidanylidene-4-[2-(trifluoromethyl)phenoxy]but-2-enoate; urea Openeye Name: (E)-4-oxo-4-[2-(trifluoromethyl)phenoxy]but-2-enoate; urea CAS Name: (E)-4-oxo-4-[2-(trifluoromethyl)phenoxy]-2-butenoate; urea IUPAC Name: (E)-4-oxo-4-[2-(trifluoromethyl)phenoxy]but-2-enoate; urea Traditional Name: (E)-4-keto-4-[2-(trifluoromethyl)phenoxy]but-2-enoate; urea Formula: C12H10F3N2O5- MolecularWeight: 319.21341

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(F)(F)F)OC(=O)C=CC(=O)[O-].C(=O)(N)N

Isomeric SMILES

C1=CC=C(C(=C1)C(F)(F)F)OC(=O)/C=C/C(=O)[O-].C(=O)(N)N

InChI

InChI=1S/C11H7F3O4.CH4N2O/c12-11(13,14)7-3-1-2-4-8(7)18-10(17)6-5-9(15)16;2-1(3)4/h1-6H,(H,15,16);(H4,2,3,4)/p-1/b6-5+;