(E)-3-(diethylcarbamoylamino)-4,4,4-tris(fluoranyl)but-2-enoate

Systemtic Name: (E)-3-(diethylcarbamoylamino)-4,4,4-tris(fluoranyl)but-2-enoate Openeye Name: (E)-3-(diethylcarbamoylamino)-4,4,4-trifluoro-but-2-enoate CAS Name: (E)-3-[[diethylamino(oxo)methyl]amino]-4,4,4-trifluoro-2-butenoate IUPAC Name: (E)-3-(diethylcarbamoylamino)-4,4,4-trifluorobut-2-enoate Traditional Name: (E)-3-(diethylcarbamoylamino)-4,4,4-trifluoro-but-2-enoate Formula: C9H12F3N2O3- MolecularWeight: 253.19839

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)NC(=CC(=O)[O-])C(F)(F)F

Isomeric SMILES

CCN(CC)C(=O)N/C(=C/C(=O)[O-])/C(F)(F)F

InChI

InChI=1S/C9H13F3N2O3/c1-3-14(4-2)8(17)13-6(5-7(15)16)9(10,11)12/h5H,3-4H2,1-2H3,(H,13,17)(H,15,16)/p-1/b6-5+