1-[(1E,3E)-5-piperidin-1-ium-1-ylidenepenta-1,3-dienyl]piperidine chloride hydrate

Systemtic Name: 1-[(1E,3E)-5-piperidin-1-ium-1-ylidenepenta-1,3-dienyl]piperidine chloride hydrate Openeye Name: 1-[(1E,3E)-5-piperidin-1-ium-1-ylidenepenta-1,3-dienyl]piperidine chloride hydrate CAS Name: 1-[(1E,3E)-5-(1-piperidin-1-iumylidene)penta-1,3-dienyl]piperidine chloride hydrate IUPAC Name: 1-[(1E,3E)-5-piperidin-1-ium-1-ylidenepenta-1,3-dienyl]piperidine chloride hydrate Traditional Name: 1-[(1E,3E)-5-piperidin-1-ium-1-ylidenepenta-1,3-dienyl]piperidine chloride hydrate Formula: C15H27ClN2O MolecularWeight: 286.84068

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C=CC=CC=[N+]2CCCCC2.O.[Cl-]

Isomeric SMILES

C1CCN(CC1)/C=C/C=C/C=[N+]2CCCCC2.O.[Cl-]

InChI

InChI=1S/C15H25N2.ClH.H2O/c1-4-10-16(11-5-1)14-8-3-9-15-17-12-6-2-7-13-17;;/h3,8-9,14-15H,1-2,4-7,10-13H2;1H;1H2/q+1;;/p-1