4-azaniumylbutyl-[[4-(dihydroxyboranyl)phenyl]methyl]azanium dichloride

Systemtic Name: 4-azaniumylbutyl-[[4-(dihydroxyboranyl)phenyl]methyl]azanium dichloride Openeye Name: 4-azaniumylbutyl-[(4-boronophenyl)methyl]ammonium dichloride CAS Name: 4-ammoniobutyl-[(4-boronophenyl)methyl]ammonium dichloride IUPAC Name: 4-azaniumylbutyl-[(4-boronophenyl)methyl]azanium dichloride Traditional Name: 4-ammoniobutyl-(4-boronobenzyl)ammonium dichloride Formula: C11H21BCl2N2O2 MolecularWeight: 295.01364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H19BN2O2.2ClH/c13-7-1-2-8-14-9-10-3-5-11(6-4-10)12(15)16;;/h3-6,14-16H,1-2,7-9,13H2;2*1H