5-[[2,6-bis(fluoranyl)phenyl]amino]-3,3-dimethyl-5-oxidanylidene-pentanoate

Systemtic Name: 5-[[2,6-bis(fluoranyl)phenyl]amino]-3,3-dimethyl-5-oxidanylidene-pentanoate Openeye Name: 5-(2,6-difluoroanilino)-3,3-dimethyl-5-oxo-pentanoate CAS Name: 5-(2,6-difluoroanilino)-3,3-dimethyl-5-oxopentanoate IUPAC Name: 5-(2,6-difluoroanilino)-3,3-dimethyl-5-oxopentanoate Traditional Name: 5-(2,6-difluoroanilino)-5-keto-3,3-dimethyl-valerate Formula: C13H14F2NO3- MolecularWeight: 270.251966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NC1=C(C=CC=C1F)F)CC(=O)[O-]

Isomeric SMILES

CC(C)(CC(=O)NC1=C(C=CC=C1F)F)CC(=O)[O-]

InChI

InChI=1S/C13H15F2NO3/c1-13(2,7-11(18)19)6-10(17)16-12-8(14)4-3-5-9(12)15/h3-5H,6-7H2,1-2H3,(H,16,17)(H,18,19)/p-1