2-(aminomethyl)-4,5-bis(hydroxymethyl)pyridin-3-ol hydrate dihydrochloride

Systemtic Name: 2-(aminomethyl)-4,5-bis(hydroxymethyl)pyridin-3-ol hydrate dihydrochloride Openeye Name: 2-(aminomethyl)-4,5-bis(hydroxymethyl)pyridin-3-ol hydrate dihydrochloride CAS Name: 2-(aminomethyl)-4,5-bis(hydroxymethyl)-3-pyridinol hydrate dihydrochloride IUPAC Name: 2-(aminomethyl)-4,5-bis(hydroxymethyl)pyridin-3-ol hydrate dihydrochloride Traditional Name: 2-(aminomethyl)-4,5-dimethylol-pyridin-3-ol hydrate dihydrochloride Formula: C8H16Cl2N2O4 MolecularWeight: 275.12964

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=N1)CN)O)CO)CO.O.Cl.Cl

Isomeric SMILES

C1=C(C(=C(C(=N1)CN)O)CO)CO.O.Cl.Cl

InChI

InChI=1S/C8H12N2O3.2ClH.H2O/c9-1-7-8(13)6(4-12)5(3-11)2-10-7;;;/h2,11-13H,1,3-4,9H2;2*1H;1H2