(E)-3-[6-azanyl-5-(2-hydroxyethylcarbamoyl)pyridin-3-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[6-azanyl-5-(2-hydroxyethylcarbamoyl)pyridin-3-yl]prop-2-enoic acid Openeye Name: (E)-3-[6-amino-5-(2-hydroxyethylcarbamoyl)-3-pyridyl]prop-2-enoic acid CAS Name: (E)-3-[6-amino-5-[(2-hydroxyethylamino)-oxomethyl]-3-pyridinyl]-2-propenoic acid IUPAC Name: (E)-3-[6-amino-5-(2-hydroxyethylcarbamoyl)pyridin-3-yl]prop-2-enoic acid Traditional Name: (E)-3-[6-amino-5-(2-hydroxyethylcarbamoyl)-3-pyridyl]acrylic acid Formula: C11H13N3O4 MolecularWeight: 251.23862

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC(=C1C(=O)NCCO)N)C=CC(=O)O

Isomeric SMILES

C1=C(C=NC(=C1C(=O)NCCO)N)/C=C/C(=O)O

InChI

InChI=1S/C11H13N3O4/c12-10-8(11(18)13-3-4-15)5-7(6-14-10)1-2-9(16)17/h1-2,5-6,15H,3-4H2,(H2,12,14)(H,13,18)(H,16,17)/b2-1+