N-[2-(4-chlorophenyl)ethyl]-5-[(4-ethanoylphenoxy)methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-5-[(4-ethanoylphenoxy)methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-[(4-acetylphenoxy)methyl]-N-[2-(4-chlorophenyl)ethyl]isoxazole-3-carboxamide CAS Name: 5-[(4-acetylphenoxy)methyl]-N-[2-(4-chlorophenyl)ethyl]-3-isoxazolecarboxamide IUPAC Name: 5-[(4-acetylphenoxy)methyl]-N-[2-(4-chlorophenyl)ethyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[(4-acetylphenoxy)methyl]-N-[2-(4-chlorophenyl)ethyl]isoxazole-3-carboxamide Formula: C21H19ClN2O4 MolecularWeight: 398.83956

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCC2=CC(=NO2)C(=O)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCC2=CC(=NO2)C(=O)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H19ClN2O4/c1-14(25)16-4-8-18(9-5-16)27-13-19-12-20(24-28-19)21(26)23-11-10-15-2-6-17(22)7-3-15/h2-9,12H,10-11,13H2,1H3,(H,23,26)