(1-methylpyrrol-2-yl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium dichloride

Systemtic Name: (1-methylpyrrol-2-yl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium dichloride Openeye Name: (1-methylpyrrol-2-yl)methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium dichloride CAS Name: (1-methyl-2-pyrrolyl)methyl-[3-(4-morpholin-4-iumyl)propyl]ammonium dichloride IUPAC Name: (1-methylpyrrol-2-yl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium dichloride Traditional Name: (1-methylpyrrol-2-yl)methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium dichloride Formula: C13H25Cl2N3O MolecularWeight: 310.2631

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C[NH2+]CCC[NH+]2CCOCC2.[Cl-].[Cl-]

Isomeric SMILES

CN1C=CC=C1C[NH2+]CCC[NH+]2CCOCC2.[Cl-].[Cl-]

InChI

InChI=1S/C13H23N3O.2ClH/c1-15-6-2-4-13(15)12-14-5-3-7-16-8-10-17-11-9-16;;/h2,4,6,14H,3,5,7-12H2,1H3;2*1H