[(E)-3-[2,3,4,5,6-pentakis(fluoranyl)phenyl]prop-2-enoyl] 2-azanyl-3-(4-fluorophenyl)propanoate

Systemtic Name: [(E)-3-[2,3,4,5,6-pentakis(fluoranyl)phenyl]prop-2-enoyl] 2-azanyl-3-(4-fluorophenyl)propanoate Openeye Name: [(E)-3-(2,3,4,5,6-pentafluorophenyl)prop-2-enoyl] 2-amino-3-(4-fluorophenyl)propanoate CAS Name: 2-amino-3-(4-fluorophenyl)propanoic acid [(E)-1-oxo-3-(2,3,4,5,6-pentafluorophenyl)prop-2-enyl] ester IUPAC Name: [(E)-3-(2,3,4,5,6-pentafluorophenyl)prop-2-enoyl] 2-amino-3-(4-fluorophenyl)propanoate Traditional Name: 2-amino-3-(4-fluorophenyl)propionic acid [(E)-3-(2,3,4,5,6-pentafluorophenyl)acryloyl] ester Formula: C18H11F6NO3 MolecularWeight: 403.275259

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)OC(=O)C=CC2=C(C(=C(C(=C2F)F)F)F)F)N)F

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)OC(=O)/C=C/C2=C(C(=C(C(=C2F)F)F)F)F)N)F

InChI

InChI=1S/C18H11F6NO3/c19-9-3-1-8(2-4-9)7-11(25)18(27)28-12(26)6-5-10-13(20)15(22)17(24)16(23)14(10)21/h1-6,11H,7,25H2/b6-5+