2,2-dimethyl-4-(1-oxidanidylpyridin-1-ium-2-yl)-6-(trifluoromethyloxy)-1,3-benzoxazine

Systemtic Name: 2,2-dimethyl-4-(1-oxidanidylpyridin-1-ium-2-yl)-6-(trifluoromethyloxy)-1,3-benzoxazine Openeye Name: 2,2-dimethyl-4-(1-oxidopyridin-1-ium-2-yl)-6-(trifluoromethoxy)-1,3-benzoxazine CAS Name: 2,2-dimethyl-4-(1-oxido-2-pyridin-1-iumyl)-6-(trifluoromethoxy)-1,3-benzoxazine IUPAC Name: 2,2-dimethyl-4-(1-oxidopyridin-1-ium-2-yl)-6-(trifluoromethoxy)-1,3-benzoxazine Traditional Name: 2,2-dimethyl-4-(1-oxidopyridin-1-ium-2-yl)-6-(trifluoromethoxy)-1,3-benzoxazine Formula: C16H13F3N2O3 MolecularWeight: 338.28123

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N=C(C2=C(O1)C=CC(=C2)OC(F)(F)F)C3=CC=CC=[N+]3[O-])C

Isomeric SMILES

CC1(N=C(C2=C(O1)C=CC(=C2)OC(F)(F)F)C3=CC=CC=[N+]3[O-])C

InChI

InChI=1S/C16H13F3N2O3/c1-15(2)20-14(12-5-3-4-8-21(12)22)11-9-10(23-16(17,18)19)6-7-13(11)24-15/h3-9H,1-2H3