N-(pyridin-1-ium-1-ylmethyl)undec-10-enamide chloride hydrate

Systemtic Name: N-(pyridin-1-ium-1-ylmethyl)undec-10-enamide chloride hydrate Openeye Name: N-(pyridin-1-ium-1-ylmethyl)undec-10-enamide chloride hydrate CAS Name: N-(1-pyridin-1-iumylmethyl)-10-undecenamide chloride hydrate IUPAC Name: N-(pyridin-1-ium-1-ylmethyl)undec-10-enamide chloride hydrate Traditional Name: N-(pyridin-1-ium-1-ylmethyl)undec-10-enamide chloride hydrate Formula: C17H29ClN2O2 MolecularWeight: 328.87736

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCCCCC(=O)NC[N+]1=CC=CC=C1.O.[Cl-]

Isomeric SMILES

C=CCCCCCCCCC(=O)NC[N+]1=CC=CC=C1.O.[Cl-]

InChI

InChI=1S/C17H26N2O.ClH.H2O/c1-2-3-4-5-6-7-8-10-13-17(20)18-16-19-14-11-9-12-15-19;;/h2,9,11-12,14-15H,1,3-8,10,13,16H2;1H;1H2