6-azanyl-4,5-bis(hydroxymethyl)-2-methyl-pyridin-1-ium-3-ol

Systemtic Name: 6-azanyl-4,5-bis(hydroxymethyl)-2-methyl-pyridin-1-ium-3-ol Openeye Name: 6-amino-4,5-bis(hydroxymethyl)-2-methyl-pyridin-1-ium-3-ol CAS Name: 6-amino-4,5-bis(hydroxymethyl)-2-methyl-3-pyridin-1-iumol IUPAC Name: 6-amino-4,5-bis(hydroxymethyl)-2-methylpyridin-1-ium-3-ol Traditional Name: 6-amino-2-methyl-4,5-dimethylol-pyridin-1-ium-3-ol Formula: C8H13N2O3+ MolecularWeight: 185.20042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=[NH+]1)N)CO)CO)O

Isomeric SMILES

CC1=C(C(=C(C(=[NH+]1)N)CO)CO)O

InChI

InChI=1S/C8H12N2O3/c1-4-7(13)5(2-11)6(3-12)8(9)10-4/h11-13H,2-3H2,1H3,(H2,9,10)/p+1