propane-1,3-diol; 2,2,2-tris(fluoranyl)ethanamide

Systemtic Name: propane-1,3-diol; 2,2,2-tris(fluoranyl)ethanamide Openeye Name: propane-1,3-diol; 2,2,2-trifluoroacetamide CAS Name: propane-1,3-diol; 2,2,2-trifluoroacetamide IUPAC Name: propane-1,3-diol; 2,2,2-trifluoroacetamide Traditional Name: propane-1,3-diol; 2,2,2-trifluoroacetamide Formula: C5H10F3NO3 MolecularWeight: 189.13301

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Descriptors Computed from Structure

Canonical SMILES:

C(CO)CO.C(=O)(C(F)(F)F)N

Isomeric SMILES

C(CO)CO.C(=O)(C(F)(F)F)N

InChI

InChI=1S/C3H8O2.C2H2F3NO/c4-2-1-3-5;3-2(4,5)1(6)7/h4-5H,1-3H2;(H2,6,7)