2-[(2S)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-[2-propoxy-5-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[(2S)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-[2-propoxy-5-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-[2-propoxy-5-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-[2-propoxy-5-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-[2-propoxy-5-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(2S)-3-keto-2-methyl-1,4-benzoxazin-4-yl]-N-[2-propoxy-5-(trifluoromethyl)phenyl]acetamide Formula: C21H21F3N2O4 MolecularWeight: 422.39765

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)CN2C3=CC=CC=C3OC(C2=O)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)CN2C3=CC=CC=C3O[C@H](C2=O)C

InChI

InChI=1S/C21H21F3N2O4/c1-3-10-29-17-9-8-14(21(22,23)24)11-15(17)25-19(27)12-26-16-6-4-5-7-18(16)30-13(2)20(26)28/h4-9,11,13H,3,10,12H2,1-2H3,(H,25,27)/t13-/m0/s1