1-[1-(azocan-5-yl)penta-2,4-dienylidene]azocan-1-ium chloride hydrate

Systemtic Name: 1-[1-(azocan-5-yl)penta-2,4-dienylidene]azocan-1-ium chloride hydrate Openeye Name: 1-[1-(azocan-5-yl)penta-2,4-dienylidene]azocan-1-ium chloride hydrate CAS Name: 1-[1-(5-azocanyl)penta-2,4-dienylidene]azocan-1-ium chloride hydrate IUPAC Name: 1-[1-(azocan-5-yl)penta-2,4-dienylidene]azocan-1-ium chloride hydrate Traditional Name: 1-[1-(azocan-5-yl)penta-2,4-dienylidene]azocan-1-ium chloride hydrate Formula: C19H35ClN2O MolecularWeight: 342.947

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Descriptors Computed from Structure

Canonical SMILES:

C=CC=CC(=[N+]1CCCCCCC1)C2CCCNCCC2.O.[Cl-]

Isomeric SMILES

C=CC=CC(=[N+]1CCCCCCC1)C2CCCNCCC2.O.[Cl-]

InChI

InChI=1S/C19H33N2.ClH.H2O/c1-2-3-13-19(18-11-9-14-20-15-10-12-18)21-16-7-5-4-6-8-17-21;;/h2-3,13,18,20H,1,4-12,14-17H2;1H;1H2/q+1;;/p-1