cyanomethyl 4-[[2,4-bis(fluoranyl)phenyl]carbonylamino]butanoate

Systemtic Name: cyanomethyl 4-[[2,4-bis(fluoranyl)phenyl]carbonylamino]butanoate Openeye Name: cyanomethyl 4-[(2,4-difluorobenzoyl)amino]butanoate CAS Name: 4-[[(2,4-difluorophenyl)-oxomethyl]amino]butanoic acid cyanomethyl ester IUPAC Name: cyanomethyl 4-[(2,4-difluorobenzoyl)amino]butanoate Traditional Name: 4-[(2,4-difluorobenzoyl)amino]butyric acid cyanomethyl ester Formula: C13H12F2N2O3 MolecularWeight: 282.242786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12F2N2O3/c14-9-3-4-10(11(15)8-9)13(19)17-6-1-2-12(18)20-7-5-16/h3-4,8H,1-2,6-7H2,(H,17,19)