3-methyl-3-phenyl-2,7-dihydroindeno[1,2-f][4,1,2]benzoxathiazin-3-ium 4-oxide

Systemtic Name: 3-methyl-3-phenyl-2,7-dihydroindeno[1,2-f][4,1,2]benzoxathiazin-3-ium 4-oxide Openeye Name: 3-methyl-3-phenyl-2,7-dihydroindeno[1,2-f][4,1,2]benzoxathiazin-3-ium 4-oxide CAS Name: 3-methyl-3-phenyl-2,7-dihydroindeno[1,2-f][4,1,2]benzoxathiazin-3-ium 4-oxide IUPAC Name: 3-methyl-3-phenyl-2,7-dihydroindeno[1,2-f][4,1,2]benzoxathiazin-3-ium 4-oxide Traditional Name: 3-methyl-3-phenyl-2,7-dihydroindeno[1,2-f][4,1,2]benzoxathiazin-3-ium 4-oxide Formula: C21H18NO2S+ MolecularWeight: 348.43812

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(COC2=C(S1=O)C=CC3=C2C4=CC=CC=C4C3)C5=CC=CC=C5

Isomeric SMILES

C[N+]1(COC2=C(S1=O)C=CC3=C2C4=CC=CC=C4C3)C5=CC=CC=C5

InChI

InChI=1S/C21H18NO2S/c1-22(17-8-3-2-4-9-17)14-24-21-19(25(22)23)12-11-16-13-15-7-5-6-10-18(15)20(16)21/h2-12H,13-14H2,1H3/q+1