8-methyl-3-[4-(trifluoromethyl)phenyl]-2H-1,3-benzothiazin-3-ium

Systemtic Name: 8-methyl-3-[4-(trifluoromethyl)phenyl]-2H-1,3-benzothiazin-3-ium Openeye Name: 8-methyl-3-[4-(trifluoromethyl)phenyl]-2H-1,3-benzothiazin-3-ium CAS Name: 8-methyl-3-[4-(trifluoromethyl)phenyl]-2H-1,3-benzothiazin-3-ium IUPAC Name: 8-methyl-3-[4-(trifluoromethyl)phenyl]-2H-1,3-benzothiazin-3-ium Traditional Name: 8-methyl-3-[4-(trifluoromethyl)phenyl]-2H-1,3-benzothiazin-3-ium Formula: C16H13F3NS+ MolecularWeight: 308.34133

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1SC[N+](=C2)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=CC2=C1SC[N+](=C2)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C16H13F3NS/c1-11-3-2-4-12-9-20(10-21-15(11)12)14-7-5-13(6-8-14)16(17,18)19/h2-9H,10H2,1H3/q+1