1-[4-[1-(4-cyanophenyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]ethylphosphonic acid dichloride

Systemtic Name: 1-[4-[1-(4-cyanophenyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]ethylphosphonic acid dichloride Openeye Name: 1-[4-[1-(4-cyanophenyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]ethylphosphonic acid dichloride CAS Name: 1-[4-[1-(4-cyanophenyl)-4-pyridin-1-iumyl]-1-pyridin-1-iumyl]ethylphosphonic acid dichloride IUPAC Name: 1-[4-[1-(4-cyanophenyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]ethylphosphonic acid dichloride Traditional Name: 1-[4-[1-(4-cyanophenyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]ethylphosphonic acid dichloride Formula: C19H18Cl2N3O3P MolecularWeight: 438.244281

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Descriptors Computed from Structure

Canonical SMILES:

CC([N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)C3=CC=C(C=C3)C#N)P(=O)(O)O.[Cl-].[Cl-]

Isomeric SMILES

CC([N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)C3=CC=C(C=C3)C#N)P(=O)(O)O.[Cl-].[Cl-]

InChI

InChI=1S/C19H16N3O3P.2ClH/c1-15(26(23,24)25)21-10-6-17(7-11-21)18-8-12-22(13-9-18)19-4-2-16(14-20)3-5-19;;/h2-13,15H,1H3;2*1H