3-[2-azanyl-5-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]pyridin-3-yl]propanoic acid

Systemtic Name: 3-[2-azanyl-5-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]pyridin-3-yl]propanoic acid Openeye Name: 3-[2-amino-5-[(E)-3-hydroxy-3-oxo-prop-1-enyl]-3-pyridyl]propanoic acid CAS Name: 3-[2-amino-5-[(E)-3-hydroxy-3-oxoprop-1-enyl]-3-pyridinyl]propanoic acid IUPAC Name: 3-[2-amino-5-[(E)-3-hydroxy-3-oxoprop-1-enyl]pyridin-3-yl]propanoic acid Traditional Name: 3-[2-amino-5-[(E)-3-hydroxy-3-keto-prop-1-enyl]-3-pyridyl]propionic acid Formula: C11H12N2O4 MolecularWeight: 236.22398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC(=C1CCC(=O)O)N)C=CC(=O)O

Isomeric SMILES

C1=C(C=NC(=C1CCC(=O)O)N)/C=C/C(=O)O

InChI

InChI=1S/C11H12N2O4/c12-11-8(2-4-10(16)17)5-7(6-13-11)1-3-9(14)15/h1,3,5-6H,2,4H2,(H2,12,13)(H,14,15)(H,16,17)/b3-1+