8,8'-dimethyl-3'-(2-methylphenyl)-3-phenyl-2,2'-spirobi[1,3-benzothiazin-3-ium]

Systemtic Name: 8,8'-dimethyl-3'-(2-methylphenyl)-3-phenyl-2,2'-spirobi[1,3-benzothiazin-3-ium] Openeye Name: 8,8'-dimethyl-3'-(o-tolyl)-3-phenyl-2,2'-spirobi[1,3-benzothiazin-3-ium] CAS Name: 8,8'-dimethyl-3'-(2-methylphenyl)-3-phenyl-2,2'-spirobi[1,3-benzothiazin-3-ium] IUPAC Name: 8,8'-dimethyl-3'-(2-methylphenyl)-3-phenyl-2,2'-spirobi[1,3-benzothiazin-3-ium] Traditional Name: 8,8'-dimethyl-3'-(o-tolyl)-3-phenyl-2,2'-spirobi[1,3-benzothiazin-3-ium] Formula: C30H26N2S2+2 MolecularWeight: 478.67084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1[N+]2=CC3=C(C(=CC=C3)C)SC24[N+](=CC5=C(S4)C(=CC=C5)C)C6=CC=CC=C6

Isomeric SMILES

CC1=CC=CC=C1[N+]2=CC3=C(C(=CC=C3)C)SC24[N+](=CC5=C(S4)C(=CC=C5)C)C6=CC=CC=C6

InChI

InChI=1S/C30H26N2S2/c1-21-11-7-8-18-27(21)32-20-25-15-10-13-23(3)29(25)34-30(32)31(26-16-5-4-6-17-26)19-24-14-9-12-22(2)28(24)33-30/h4-20H,1-3H3/q+2