N-cyclohexyl-5-[(3-ethanoylphenoxy)methyl]-N-prop-2-ynyl-1,2-oxazole-3-carboxamide

Systemtic Name: N-cyclohexyl-5-[(3-ethanoylphenoxy)methyl]-N-prop-2-ynyl-1,2-oxazole-3-carboxamide Openeye Name: 5-[(3-acetylphenoxy)methyl]-N-cyclohexyl-N-prop-2-ynyl-isoxazole-3-carboxamide CAS Name: 5-[(3-acetylphenoxy)methyl]-N-cyclohexyl-N-prop-2-ynyl-3-isoxazolecarboxamide IUPAC Name: 5-[(3-acetylphenoxy)methyl]-N-cyclohexyl-N-prop-2-ynyl-1,2-oxazole-3-carboxamide Traditional Name: 5-[(3-acetylphenoxy)methyl]-N-cyclohexyl-N-propargyl-isoxazole-3-carboxamide Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)OCC2=CC(=NO2)C(=O)N(CC#C)C3CCCCC3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)OCC2=CC(=NO2)C(=O)N(CC#C)C3CCCCC3

InChI

InChI=1S/C22H24N2O4/c1-3-12-24(18-9-5-4-6-10-18)22(26)21-14-20(28-23-21)15-27-19-11-7-8-17(13-19)16(2)25/h1,7-8,11,13-14,18H,4-6,9-10,12,15H2,2H3