[4-(hydroxymethyl)-1-pyridin-1-ium-4-yl-piperidin-4-yl]methylazanium dichloride

Systemtic Name: [4-(hydroxymethyl)-1-pyridin-1-ium-4-yl-piperidin-4-yl]methylazanium dichloride Openeye Name: [4-(hydroxymethyl)-1-pyridin-1-ium-4-yl-4-piperidyl]methylammonium dichloride CAS Name: [4-(hydroxymethyl)-1-(4-pyridin-1-iumyl)-4-piperidinyl]methylammonium dichloride IUPAC Name: [4-(hydroxymethyl)-1-pyridin-1-ium-4-ylpiperidin-4-yl]methylazanium dichloride Traditional Name: (4-methylol-1-pyridin-1-ium-4-yl-4-piperidyl)methylammonium dichloride Formula: C12H21Cl2N3O MolecularWeight: 294.22064

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C[NH3+])CO)C2=CC=[NH+]C=C2.[Cl-].[Cl-]

Isomeric SMILES

C1CN(CCC1(C[NH3+])CO)C2=CC=[NH+]C=C2.[Cl-].[Cl-]

InChI

InChI=1S/C12H19N3O.2ClH/c13-9-12(10-16)3-7-15(8-4-12)11-1-5-14-6-2-11;;/h1-2,5-6,16H,3-4,7-10,13H2;2*1H