(2S)-2-[[4-(trifluoromethyloxy)phenyl]methylcarbamoylamino]propanoate

Systemtic Name: (2S)-2-[[4-(trifluoromethyloxy)phenyl]methylcarbamoylamino]propanoate Openeye Name: (2S)-2-[[4-(trifluoromethoxy)phenyl]methylcarbamoylamino]propanoate CAS Name: (2S)-2-[[oxo-[[4-(trifluoromethoxy)phenyl]methylamino]methyl]amino]propanoate IUPAC Name: (2S)-2-[[4-(trifluoromethoxy)phenyl]methylcarbamoylamino]propanoate Traditional Name: (2S)-2-[[4-(trifluoromethoxy)benzyl]carbamoylamino]propionate Formula: C12H12F3N2O4- MolecularWeight: 305.22989

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC(=O)NCC1=CC=C(C=C1)OC(F)(F)F

Isomeric SMILES

C[C@@H](C(=O)[O-])NC(=O)NCC1=CC=C(C=C1)OC(F)(F)F

InChI

InChI=1S/C12H13F3N2O4/c1-7(10(18)19)17-11(20)16-6-8-2-4-9(5-3-8)21-12(13,14)15/h2-5,7H,6H2,1H3,(H,18,19)(H2,16,17,20)/p-1/t7-/m0/s1