8-(1,1-diphenylethyl)-3-phenyl-2H-1,3-benzothiazin-3-ium

Systemtic Name: 8-(1,1-diphenylethyl)-3-phenyl-2H-1,3-benzothiazin-3-ium Openeye Name: 8-(1,1-diphenylethyl)-3-phenyl-2H-1,3-benzothiazin-3-ium CAS Name: 8-(1,1-diphenylethyl)-3-phenyl-2H-1,3-benzothiazin-3-ium IUPAC Name: 8-(1,1-diphenylethyl)-3-phenyl-2H-1,3-benzothiazin-3-ium Traditional Name: 8-(1,1-diphenylethyl)-3-phenyl-2H-1,3-benzothiazin-3-ium Formula: C28H24NS+ MolecularWeight: 406.56186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC4=C3SC[N+](=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC4=C3SC[N+](=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H24NS/c1-28(23-13-5-2-6-14-23,24-15-7-3-8-16-24)26-19-11-12-22-20-29(21-30-27(22)26)25-17-9-4-10-18-25/h2-20H,21H2,1H3/q+1