heptan-3-yl 3-[2,5-bis(fluoranyl)phenyl]-3-oxidanylidene-propanoate

Systemtic Name: heptan-3-yl 3-[2,5-bis(fluoranyl)phenyl]-3-oxidanylidene-propanoate Openeye Name: 1-ethylpentyl 3-(2,5-difluorophenyl)-3-oxo-propanoate CAS Name: 3-(2,5-difluorophenyl)-3-oxopropanoic acid heptan-3-yl ester IUPAC Name: heptan-3-yl 3-(2,5-difluorophenyl)-3-oxopropanoate Traditional Name: 3-(2,5-difluorophenyl)-3-keto-propionic acid 1-ethylpentyl ester Formula: C16H20F2O3 MolecularWeight: 298.325006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)OC(=O)CC(=O)C1=C(C=CC(=C1)F)F

Isomeric SMILES

CCCCC(CC)OC(=O)CC(=O)C1=C(C=CC(=C1)F)F

InChI

InChI=1S/C16H20F2O3/c1-3-5-6-12(4-2)21-16(20)10-15(19)13-9-11(17)7-8-14(13)18/h7-9,12H,3-6,10H2,1-2H3