(E)-3-[6-azanyl-5-(hydroxymethyl)pyridin-3-yl]prop-2-enoate

Systemtic Name: (E)-3-[6-azanyl-5-(hydroxymethyl)pyridin-3-yl]prop-2-enoate Openeye Name: (E)-3-[6-amino-5-(hydroxymethyl)-3-pyridyl]prop-2-enoate CAS Name: (E)-3-[6-amino-5-(hydroxymethyl)-3-pyridinyl]-2-propenoate IUPAC Name: (E)-3-[6-amino-5-(hydroxymethyl)pyridin-3-yl]prop-2-enoate Traditional Name: (E)-3-(6-amino-5-methylol-3-pyridyl)acrylate Formula: C9H9N2O3- MolecularWeight: 193.17936

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC(=C1CO)N)C=CC(=O)[O-]

Isomeric SMILES

C1=C(C=NC(=C1CO)N)/C=C/C(=O)[O-]

InChI

InChI=1S/C9H10N2O3/c10-9-7(5-12)3-6(4-11-9)1-2-8(13)14/h1-4,12H,5H2,(H2,10,11)(H,13,14)/p-1/b2-1+