tetrakis(5-benzamidopentyl)azanium chloride

Systemtic Name: tetrakis(5-benzamidopentyl)azanium chloride Openeye Name: tetrakis(5-benzamidopentyl)ammonium chloride CAS Name: tetrakis(5-benzamidopentyl)ammonium chloride IUPAC Name: tetrakis(5-benzamidopentyl)azanium chloride Traditional Name: tetrakis(5-benzamidopentyl)ammonium chloride Formula: C48H64ClN5O4 MolecularWeight: 810.50586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCCCCC[N+](CCCCCNC(=O)C2=CC=CC=C2)(CCCCCNC(=O)C3=CC=CC=C3)CCCCCNC(=O)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCCCCC[N+](CCCCCNC(=O)C2=CC=CC=C2)(CCCCCNC(=O)C3=CC=CC=C3)CCCCCNC(=O)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C48H63N5O4.ClH/c54-45(41-25-9-1-10-26-41)49-33-17-5-21-37-53(38-22-6-18-34-50-46(55)42-27-11-2-12-28-42,39-23-7-19-35-51-47(56)43-29-13-3-14-30-43)40-24-8-20-36-52-48(57)44-31-15-4-16-32-44;/h1-4,9-16,25-32H,5-8,17-24,33-40H2,(H3-,49,50,51,52,54,55,56,57);1H