dimethyl-(18-phenyloctadecyl)-[3-(trimethylazaniumyl)propyl]azanium dichloride

Systemtic Name: dimethyl-(18-phenyloctadecyl)-[3-(trimethylazaniumyl)propyl]azanium dichloride Openeye Name: dimethyl-(18-phenyloctadecyl)-[3-(trimethylammonio)propyl]ammonium dichloride CAS Name: dimethyl-(18-phenyloctadecyl)-[3-(trimethylammonio)propyl]ammonium dichloride IUPAC Name: dimethyl-(18-phenyloctadecyl)-[3-(trimethylazaniumyl)propyl]azanium dichloride Traditional Name: dimethyl-(18-phenyloctadecyl)-[3-(trimethylammonio)propyl]ammonium dichloride Formula: C32H62Cl2N2 MolecularWeight: 545.75408

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCC[N+](C)(C)CCCCCCCCCCCCCCCCCCC1=CC=CC=C1.[Cl-].[Cl-]

Isomeric SMILES

C[N+](C)(C)CCC[N+](C)(C)CCCCCCCCCCCCCCCCCCC1=CC=CC=C1.[Cl-].[Cl-]

InChI

InChI=1S/C32H62N2.2ClH/c1-33(2,3)29-25-31-34(4,5)30-24-19-17-15-13-11-9-7-6-8-10-12-14-16-18-21-26-32-27-22-20-23-28-32;;/h20,22-23,27-28H,6-19,21,24-26,29-31H2,1-5H3;2*1H/q+2;;/p-2