zinc [2-[4-[[4-(diethylamino)-2-methyl-phenyl]diazenyl]phenyl]-2-oxidanylidene-ethyl]-trimethyl-azanium tetrachloride

Systemtic Name: zinc [2-[4-[[4-(diethylamino)-2-methyl-phenyl]diazenyl]phenyl]-2-oxidanylidene-ethyl]-trimethyl-azanium tetrachloride Openeye Name: zinc [2-[4-[4-(diethylamino)-2-methyl-phenyl]azophenyl]-2-oxo-ethyl]-trimethyl-ammonium tetrachloride CAS Name: zinc [2-[4-[4-(diethylamino)-2-methylphenyl]azophenyl]-2-oxoethyl]-trimethylammonium tetrachloride IUPAC Name: zinc [2-[4-[[4-(diethylamino)-2-methylphenyl]diazenyl]phenyl]-2-oxoethyl]-trimethylazanium tetrachloride Traditional Name: zinc [2-[4-[4-(diethylamino)-2-methyl-phenyl]azophenyl]-2-keto-ethyl]-trimethyl-ammonium tetrachloride Formula: C44H62Cl4N8O2Zn MolecularWeight: 942.23648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)N=NC2=CC=C(C=C2)C(=O)C[N+](C)(C)C)C.CCN(CC)C1=CC(=C(C=C1)N=NC2=CC=C(C=C2)C(=O)C[N+](C)(C)C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)N=NC2=CC=C(C=C2)C(=O)C[N+](C)(C)C)C.CCN(CC)C1=CC(=C(C=C1)N=NC2=CC=C(C=C2)C(=O)C[N+](C)(C)C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]

InChI

InChI=1S/2C22H31N4O.4ClH.Zn/c2*1-7-25(8-2)20-13-14-21(17(3)15-20)24-23-19-11-9-18(10-12-19)22(27)16-26(4,5)6;;;;;/h2*9-15H,7-8,16H2,1-6H3;4*1H;/q2*+1;;;;;+2/p-4