tris(4-methylphenyl)-[(4-methylphenyl)amino]azanium stiborate hexahydrochloride

Systemtic Name: tris(4-methylphenyl)-[(4-methylphenyl)amino]azanium stiborate hexahydrochloride Openeye Name: (4-methylanilino)-tris(p-tolyl)ammonium stiborate hexahydrochloride CAS Name: (4-methylanilino)-tris(4-methylphenyl)ammonium stiborate hexahydrochloride IUPAC Name: (4-methylanilino)-tris(4-methylphenyl)azanium stiborate hexahydrochloride Traditional Name: p-toluidino(tris-p-tolyl)ammonium stiborate hexahydrochloride Formula: C84H93Cl6N6O4Sb MolecularWeight: 1585.15302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N[N+](C2=CC=C(C=C2)C)(C3=CC=C(C=C3)C)C4=CC=C(C=C4)C.CC1=CC=C(C=C1)N[N+](C2=CC=C(C=C2)C)(C3=CC=C(C=C3)C)C4=CC=C(C=C4)C.CC1=CC=C(C=C1)N[N+](C2=CC=C(C=C2)C)(C3=CC=C(C=C3)C)C4=CC=C(C=C4)C.[O-][Sb](=O)([O-])[O-].Cl.Cl.Cl.Cl.Cl.Cl

Isomeric SMILES

CC1=CC=C(C=C1)N[N+](C2=CC=C(C=C2)C)(C3=CC=C(C=C3)C)C4=CC=C(C=C4)C.CC1=CC=C(C=C1)N[N+](C2=CC=C(C=C2)C)(C3=CC=C(C=C3)C)C4=CC=C(C=C4)C.CC1=CC=C(C=C1)N[N+](C2=CC=C(C=C2)C)(C3=CC=C(C=C3)C)C4=CC=C(C=C4)C.[O-][Sb](=O)([O-])[O-].Cl.Cl.Cl.Cl.Cl.Cl

InChI

InChI=1S/3C28H29N2.6ClH.4O.Sb/c3*1-21-5-13-25(14-6-21)29-30(26-15-7-22(2)8-16-26,27-17-9-23(3)10-18-27)28-19-11-24(4)12-20-28;;;;;;;;;;;/h3*5-20,29H,1-4H3;6*1H;;;;;/q3*+1;;;;;;;;3*-1;