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

Systemtic Name: N-[1-(4-methylpent-1-ynyl)-2-oxidanylidene-4-(trifluoromethyl)-4H-3,1-benzoxazin-6-yl]ethanamide Openeye Name: N-[1-(4-methylpent-1-ynyl)-2-oxo-4-(trifluoromethyl)-4H-3,1-benzoxazin-6-yl]acetamide CAS Name: N-[1-(4-methylpent-1-ynyl)-2-oxo-4-(trifluoromethyl)-4H-3,1-benzoxazin-6-yl]acetamide IUPAC Name: N-[1-(4-methylpent-1-ynyl)-2-oxo-4-(trifluoromethyl)-4H-3,1-benzoxazin-6-yl]acetamide Traditional Name: N-[2-keto-1-(4-methylpent-1-ynyl)-4-(trifluoromethyl)-4H-3,1-benzoxazin-6-yl]acetamide Formula: C17H17F3N2O3 MolecularWeight: 354.32369

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC#CN1C2=C(C=C(C=C2)NC(=O)C)C(OC1=O)C(F)(F)F

Isomeric SMILES

CC(C)CC#CN1C2=C(C=C(C=C2)NC(=O)C)C(OC1=O)C(F)(F)F

InChI

InChI=1S/C17H17F3N2O3/c1-10(2)5-4-8-22-14-7-6-12(21-11(3)23)9-13(14)15(17(18,19)20)25-16(22)24/h6-7,9-10,15H,5H2,1-3H3,(H,21,23)