1-(2,7-dimethyl-1-oxidanylidene-2-phenyl-3H-4,1$l^{4},2-benzoxathiazin-2-ium-5-yl)ethanone

Systemtic Name: 1-(2,7-dimethyl-1-oxidanylidene-2-phenyl-3H-4,1$l^{4},2-benzoxathiazin-2-ium-5-yl)ethanone Openeye Name: 1-(2,7-dimethyl-1-oxo-2-phenyl-3H-4,1$l^{4},2-benzoxathiazin-2-ium-5-yl)ethanone CAS Name: 1-(2,7-dimethyl-1-oxo-2-phenyl-3H-4,1$l^{4},2-benzoxathiazin-2-ium-5-yl)ethanone IUPAC Name: 1-(2,7-dimethyl-1-oxo-2-phenyl-3H-4,1$l^{4},2-benzoxathiazin-2-ium-5-yl)ethanone Traditional Name: 1-(1-keto-2,7-dimethyl-2-phenyl-3H-4,1$l^{4},2-benzoxathiazin-2-ium-5-yl)ethanone Formula: C17H18NO3S+ MolecularWeight: 316.39472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1)C(=O)C)OC[N+](S2=O)(C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C(=C1)C(=O)C)OC[N+](S2=O)(C)C3=CC=CC=C3

InChI

InChI=1S/C17H18NO3S/c1-12-9-15(13(2)19)17-16(10-12)22(20)18(3,11-21-17)14-7-5-4-6-8-14/h4-10H,11H2,1-3H3/q+1