N-[2,2-dimethyl-6-(trifluoromethylsulfonyl)-3H-1,4-benzoxazin-4-yl]ethanamide

Systemtic Name: N-[2,2-dimethyl-6-(trifluoromethylsulfonyl)-3H-1,4-benzoxazin-4-yl]ethanamide Openeye Name: N-[2,2-dimethyl-6-(trifluoromethylsulfonyl)-3H-1,4-benzoxazin-4-yl]acetamide CAS Name: N-[2,2-dimethyl-6-(trifluoromethylsulfonyl)-3H-1,4-benzoxazin-4-yl]acetamide IUPAC Name: N-[2,2-dimethyl-6-(trifluoromethylsulfonyl)-3H-1,4-benzoxazin-4-yl]acetamide Traditional Name: N-(2,2-dimethyl-6-triflyl-3H-1,4-benzoxazin-4-yl)acetamide Formula: C13H15F3N2O4S MolecularWeight: 352.32941

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NN1CC(OC2=C1C=C(C=C2)S(=O)(=O)C(F)(F)F)(C)C

Isomeric SMILES

CC(=O)NN1CC(OC2=C1C=C(C=C2)S(=O)(=O)C(F)(F)F)(C)C

InChI

InChI=1S/C13H15F3N2O4S/c1-8(19)17-18-7-12(2,3)22-11-5-4-9(6-10(11)18)23(20,21)13(14,15)16/h4-6H,7H2,1-3H3,(H,17,19)