N-[[5-oxidanylidene-4-(2-piperazin-1-ylphenyl)-1,2-oxazol-2-yl]methyl]ethanamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: N-[[5-oxidanylidene-4-(2-piperazin-1-ylphenyl)-1,2-oxazol-2-yl]methyl]ethanamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: N-[[5-oxo-4-(2-piperazin-1-ylphenyl)isoxazol-2-yl]methyl]acetamide; 2,2,2-trifluoroacetic acid CAS Name: N-[[5-oxo-4-[2-(1-piperazinyl)phenyl]-2-isoxazolyl]methyl]acetamide; 2,2,2-trifluoroacetic acid IUPAC Name: N-[[5-oxo-4-(2-piperazin-1-ylphenyl)-1,2-oxazol-2-yl]methyl]acetamide; 2,2,2-trifluoroacetic acid Traditional Name: N-[[5-keto-4-(2-piperazinophenyl)-3-isoxazolin-2-yl]methyl]acetamide; 2,2,2-trifluoroacetic acid Formula: C18H21F3N4O5 MolecularWeight: 430.37835

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCN1C=C(C(=O)O1)C2=CC=CC=C2N3CCNCC3.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC(=O)NCN1C=C(C(=O)O1)C2=CC=CC=C2N3CCNCC3.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C16H20N4O3.C2HF3O2/c1-12(21)18-11-20-10-14(16(22)23-20)13-4-2-3-5-15(13)19-8-6-17-7-9-19;3-2(4,5)1(6)7/h2-5,10,17H,6-9,11H2,1H3,(H,18,21);(H,6,7)