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

Systemtic Name: 2,2-dimethyl-4-(1-oxidanidylpyridin-1-ium-2-yl)-6-(trifluoromethylsulfonyl)-3H-1,4-benzoxazine Openeye Name: 2,2-dimethyl-4-(1-oxidopyridin-1-ium-2-yl)-6-(trifluoromethylsulfonyl)-3H-1,4-benzoxazine CAS Name: 2,2-dimethyl-4-(1-oxido-2-pyridin-1-iumyl)-6-(trifluoromethylsulfonyl)-3H-1,4-benzoxazine IUPAC Name: 2,2-dimethyl-4-(1-oxidopyridin-1-ium-2-yl)-6-(trifluoromethylsulfonyl)-3H-1,4-benzoxazine Traditional Name: 2,2-dimethyl-4-(1-oxidopyridin-1-ium-2-yl)-6-triflyl-3H-1,4-benzoxazine Formula: C16H15F3N2O4S MolecularWeight: 388.36151

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15F3N2O4S/c1-15(2)10-20(14-5-3-4-8-21(14)22)12-9-11(6-7-13(12)25-15)26(23,24)16(17,18)19/h3-9H,10H2,1-2H3