cyanomethyl 2-[[2,6-bis(fluoranyl)phenyl]carbonylamino]-3-methyl-butanoate

Systemtic Name: cyanomethyl 2-[[2,6-bis(fluoranyl)phenyl]carbonylamino]-3-methyl-butanoate Openeye Name: cyanomethyl 2-[(2,6-difluorobenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(2,6-difluorophenyl)-oxomethyl]amino]-3-methylbutanoic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-[(2,6-difluorobenzoyl)amino]-3-methylbutanoate Traditional Name: 2-[(2,6-difluorobenzoyl)amino]-3-methyl-butyric acid cyanomethyl ester Formula: C14H14F2N2O3 MolecularWeight: 296.269366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC#N)NC(=O)C1=C(C=CC=C1F)F

Isomeric SMILES

CC(C)C(C(=O)OCC#N)NC(=O)C1=C(C=CC=C1F)F

InChI

InChI=1S/C14H14F2N2O3/c1-8(2)12(14(20)21-7-6-17)18-13(19)11-9(15)4-3-5-10(11)16/h3-5,8,12H,7H2,1-2H3,(H,18,19)