1,3-bis[4-(dimethylamino)pyridin-1-ium-1-yl]propan-2-ol diperchlorate

Systemtic Name: 1,3-bis[4-(dimethylamino)pyridin-1-ium-1-yl]propan-2-ol diperchlorate Openeye Name: 1,3-bis[4-(dimethylamino)pyridin-1-ium-1-yl]propan-2-ol diperchlorate CAS Name: 1,3-bis[4-(dimethylamino)-1-pyridin-1-iumyl]-2-propanol diperchlorate IUPAC Name: 1,3-bis[4-(dimethylamino)pyridin-1-ium-1-yl]propan-2-ol diperchlorate Traditional Name: 1,3-bis[4-(dimethylamino)pyridin-1-ium-1-yl]propan-2-ol diperchlorate Formula: C17H26Cl2N4O9 MolecularWeight: 501.31574

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)CC(C[N+]2=CC=C(C=C2)N(C)C)O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)CC(C[N+]2=CC=C(C=C2)N(C)C)O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C17H26N4O.2ClHO4/c1-18(2)15-5-9-20(10-6-15)13-17(22)14-21-11-7-16(8-12-21)19(3)4;2*2-1(3,4)5/h5-12,17,22H,13-14H2,1-4H3;2*(H,2,3,4,5)/q+2;;/p-2