6-azanyl-2-chloranyl-1-(1-methoxypropyl)-4-(1-methoxypropylamino)pyridin-1-ium-3-carbonitrile chloride

Systemtic Name: 6-azanyl-2-chloranyl-1-(1-methoxypropyl)-4-(1-methoxypropylamino)pyridin-1-ium-3-carbonitrile chloride Openeye Name: 6-amino-2-chloro-1-(1-methoxypropyl)-4-(1-methoxypropylamino)pyridin-1-ium-3-carbonitrile chloride CAS Name: 6-amino-2-chloro-1-(1-methoxypropyl)-4-(1-methoxypropylamino)-3-pyridin-1-iumcarbonitrile chloride IUPAC Name: 6-amino-2-chloro-1-(1-methoxypropyl)-4-(1-methoxypropylamino)pyridin-1-ium-3-carbonitrile chloride Traditional Name: 6-amino-2-chloro-1-(1-methoxypropyl)-4-(1-methoxypropylamino)pyridin-1-ium-3-carbonitrile chloride Formula: C14H22Cl2N4O2 MolecularWeight: 349.25608

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Descriptors Computed from Structure

Canonical SMILES:

CCC(NC1=CC(=[N+](C(=C1C#N)Cl)C(CC)OC)N)OC.[Cl-]

Isomeric SMILES

CCC(NC1=CC(=[N+](C(=C1C#N)Cl)C(CC)OC)N)OC.[Cl-]

InChI

InChI=1S/C14H21ClN4O2.ClH/c1-5-12(20-3)18-10-7-11(17)19(13(6-2)21-4)14(15)9(10)8-16;/h7,12-13H,5-6H2,1-4H3,(H2,17,18);1H