N-[4-acetamido-2-(trifluoromethyl)phenyl]-3-[(2R)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]propanamide

Systemtic Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-3-[(2R)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]propanamide Openeye Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-3-[(2R)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanamide CAS Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-3-[(2R)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanamide IUPAC Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-3-[(2R)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanamide Traditional Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-3-[(2R)-3-keto-2-methyl-1,4-benzoxazin-4-yl]propionamide Formula: C21H20F3N3O4 MolecularWeight: 435.39641

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NC3=C(C=C(C=C3)NC(=O)C)C(F)(F)F

Isomeric SMILES

C[C@@H]1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NC3=C(C=C(C=C3)NC(=O)C)C(F)(F)F

InChI

InChI=1S/C21H20F3N3O4/c1-12-20(30)27(17-5-3-4-6-18(17)31-12)10-9-19(29)26-16-8-7-14(25-13(2)28)11-15(16)21(22,23)24/h3-8,11-12H,9-10H2,1-2H3,(H,25,28)(H,26,29)/t12-/m1/s1