2-piperazine-1,4-diium-1-ylethyl(quinazolin-4-yl)azanium trichloride

Systemtic Name: 2-piperazine-1,4-diium-1-ylethyl(quinazolin-4-yl)azanium trichloride Openeye Name: 2-piperazine-1,4-diium-1-ylethyl(quinazolin-4-yl)ammonium trichloride CAS Name: 2-(1-piperazine-1,4-diiumyl)ethyl-(4-quinazolinyl)ammonium trichloride IUPAC Name: 2-piperazine-1,4-diium-1-ylethyl(quinazolin-4-yl)azanium trichloride Traditional Name: 2-piperazine-1,4-diium-1-ylethyl(quinazolin-4-yl)ammonium trichloride Formula: C14H22Cl3N5 MolecularWeight: 366.71698

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)CC[NH2+]C2=NC=NC3=CC=CC=C32.[Cl-].[Cl-].[Cl-]

Isomeric SMILES

C1C[NH+](CC[NH2+]1)CC[NH2+]C2=NC=NC3=CC=CC=C32.[Cl-].[Cl-].[Cl-]

InChI

InChI=1S/C14H19N5.3ClH/c1-2-4-13-12(3-1)14(18-11-17-13)16-7-10-19-8-5-15-6-9-19;;;/h1-4,11,15H,5-10H2,(H,16,17,18);3*1H