1-[[4-(pyridin-1-ium-1-ylmethyl)phenyl]methyl]pyridin-1-ium dichloride

Systemtic Name: 1-[[4-(pyridin-1-ium-1-ylmethyl)phenyl]methyl]pyridin-1-ium dichloride Openeye Name: 1-[[4-(pyridin-1-ium-1-ylmethyl)phenyl]methyl]pyridin-1-ium dichloride CAS Name: 1-[[4-(1-pyridin-1-iumylmethyl)phenyl]methyl]pyridin-1-ium dichloride IUPAC Name: 1-[[4-(pyridin-1-ium-1-ylmethyl)phenyl]methyl]pyridin-1-ium dichloride Traditional Name: 1-[4-(pyridin-1-ium-1-ylmethyl)benzyl]pyridin-1-ium dichloride Formula: C18H18Cl2N2 MolecularWeight: 333.25492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC2=CC=C(C=C2)C[N+]3=CC=CC=C3.[Cl-].[Cl-]

Isomeric SMILES

C1=CC=[N+](C=C1)CC2=CC=C(C=C2)C[N+]3=CC=CC=C3.[Cl-].[Cl-]

InChI

InChI=1S/C18H18N2.2ClH/c1-3-11-19(12-4-1)15-17-7-9-18(10-8-17)16-20-13-5-2-6-14-20;;/h1-14H,15-16H2;2*1H/q+2;;/p-2