2-[(4-azaniumylphenyl)-azanyl-methylidene]azaniumylethyl-diethyl-azanium trichloride

Systemtic Name: 2-[(4-azaniumylphenyl)-azanyl-methylidene]azaniumylethyl-diethyl-azanium trichloride Openeye Name: 2-[amino-(4-azaniumylphenyl)methylene]ammonioethyl-diethyl-ammonium trichloride CAS Name: 2-[amino-(4-ammoniophenyl)methylidene]ammonioethyl-diethylammonium trichloride IUPAC Name: 2-[amino-(4-azaniumylphenyl)methylidene]azaniumylethyl-diethylazanium trichloride Traditional Name: 2-[amino-(4-ammoniophenyl)methylene]ammonioethyl-diethyl-ammonium trichloride Formula: C13H25Cl3N4 MolecularWeight: 343.7234

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC[NH+]=C(C1=CC=C(C=C1)[NH3+])N.[Cl-].[Cl-].[Cl-]

Isomeric SMILES

CC[NH+](CC)CC/[NH+]=C(/C1=CC=C(C=C1)[NH3+])\N.[Cl-].[Cl-].[Cl-]

InChI

InChI=1S/C13H22N4.3ClH/c1-3-17(4-2)10-9-16-13(15)11-5-7-12(14)8-6-11;;;/h5-8H,3-4,9-10,14H2,1-2H3,(H2,15,16);3*1H