N-[4-(2-cyclopropylethynyl)-2-oxidanylidene-4-(trifluoromethyl)-1H-3,1-benzoxazin-6-yl]ethanamide

Systemtic Name: N-[4-(2-cyclopropylethynyl)-2-oxidanylidene-4-(trifluoromethyl)-1H-3,1-benzoxazin-6-yl]ethanamide Openeye Name: N-[4-(2-cyclopropylethynyl)-2-oxo-4-(trifluoromethyl)-1H-3,1-benzoxazin-6-yl]acetamide CAS Name: N-[4-(2-cyclopropylethynyl)-2-oxo-4-(trifluoromethyl)-1H-3,1-benzoxazin-6-yl]acetamide IUPAC Name: N-[4-(2-cyclopropylethynyl)-2-oxo-4-(trifluoromethyl)-1H-3,1-benzoxazin-6-yl]acetamide Traditional Name: N-[4-(2-cyclopropylethynyl)-2-keto-4-(trifluoromethyl)-1H-3,1-benzoxazin-6-yl]acetamide Formula: C16H13F3N2O3 MolecularWeight: 338.28123

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)NC(=O)OC2(C#CC3CC3)C(F)(F)F

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)NC(=O)OC2(C#CC3CC3)C(F)(F)F

InChI

InChI=1S/C16H13F3N2O3/c1-9(22)20-11-4-5-13-12(8-11)15(16(17,18)19,24-14(23)21-13)7-6-10-2-3-10/h4-5,8,10H,2-3H2,1H3,(H,20,22)(H,21,23)