2,2,2-tris(fluoranyl)ethyl (E)-5-(3-nitrophenyl)-3-oxidanylidene-pent-4-enoate

Systemtic Name: 2,2,2-tris(fluoranyl)ethyl (E)-5-(3-nitrophenyl)-3-oxidanylidene-pent-4-enoate Openeye Name: 2,2,2-trifluoroethyl (E)-5-(3-nitrophenyl)-3-oxo-pent-4-enoate CAS Name: (E)-5-(3-nitrophenyl)-3-oxo-4-pentenoic acid 2,2,2-trifluoroethyl ester IUPAC Name: 2,2,2-trifluoroethyl (E)-5-(3-nitrophenyl)-3-oxopent-4-enoate Traditional Name: (E)-3-keto-5-(3-nitrophenyl)pent-4-enoic acid 2,2,2-trifluoroethyl ester Formula: C13H10F3NO5 MolecularWeight: 317.21741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=O)CC(=O)OCC(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C(=O)CC(=O)OCC(F)(F)F

InChI

InChI=1S/C13H10F3NO5/c14-13(15,16)8-22-12(19)7-11(18)5-4-9-2-1-3-10(6-9)17(20)21/h1-6H,7-8H2/b5-4+