4-azaniumylbutyl-(phenylmethyl)azanium dichloride

Systemtic Name: 4-azaniumylbutyl-(phenylmethyl)azanium dichloride Openeye Name: 4-azaniumylbutyl(benzyl)ammonium dichloride CAS Name: 4-ammoniobutyl-(phenylmethyl)ammonium dichloride IUPAC Name: 4-azaniumylbutyl(benzyl)azanium dichloride Traditional Name: 4-ammoniobutyl(benzyl)ammonium dichloride Formula: C11H20Cl2N2 MolecularWeight: 251.1959

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH2+]CCCC[NH3+].[Cl-].[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C[NH2+]CCCC[NH3+].[Cl-].[Cl-]

InChI

InChI=1S/C11H18N2.2ClH/c12-8-4-5-9-13-10-11-6-2-1-3-7-11;;/h1-3,6-7,13H,4-5,8-10,12H2;2*1H