4,4-bis(fluoranyl)but-3-enyl 4-methyl-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: 4,4-bis(fluoranyl)but-3-enyl 4-methyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: 4,4-difluorobut-3-enyl 4-methyl-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-methyl-2-phenyl-5-pyrimidinecarboxylic acid 4,4-difluorobut-3-enyl ester IUPAC Name: 4,4-difluorobut-3-enyl 4-methyl-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-methyl-2-phenyl-pyrimidine-5-carboxylic acid 4,4-difluorobut-3-enyl ester Formula: C16H14F2N2O2 MolecularWeight: 304.291366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)OCCC=C(F)F)C2=CC=CC=C2

Isomeric SMILES

CC1=NC(=NC=C1C(=O)OCCC=C(F)F)C2=CC=CC=C2

InChI

InChI=1S/C16H14F2N2O2/c1-11-13(16(21)22-9-5-8-14(17)18)10-19-15(20-11)12-6-3-2-4-7-12/h2-4,6-8,10H,5,9H2,1H3