4-[[2-bromanyl-4,6-bis(fluoranyl)phenyl]amino]-2,2-diethyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[2-bromanyl-4,6-bis(fluoranyl)phenyl]amino]-2,2-diethyl-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-bromo-4,6-difluoro-anilino)-2,2-diethyl-4-oxo-butanoic acid CAS Name: 4-(2-bromo-4,6-difluoroanilino)-2,2-diethyl-4-oxobutanoic acid IUPAC Name: 4-(2-bromo-4,6-difluoroanilino)-2,2-diethyl-4-oxobutanoic acid Traditional Name: 4-(2-bromo-4,6-difluoro-anilino)-2,2-diethyl-4-keto-butyric acid Formula: C14H16BrF2NO3 MolecularWeight: 364.182546

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC(=O)NC1=C(C=C(C=C1Br)F)F)C(=O)O

Isomeric SMILES

CCC(CC)(CC(=O)NC1=C(C=C(C=C1Br)F)F)C(=O)O

InChI

InChI=1S/C14H16BrF2NO3/c1-3-14(4-2,13(20)21)7-11(19)18-12-9(15)5-8(16)6-10(12)17/h5-6H,3-4,7H2,1-2H3,(H,18,19)(H,20,21)