3-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methyl]amino]oxypropanoic acid

Systemtic Name: 3-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methyl]amino]oxypropanoic acid Openeye Name: 3-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridylidene]methyl]amino]oxypropanoic acid CAS Name: 3-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridinylidene]methyl]amino]oxypropanoic acid IUPAC Name: 3-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]methyl]amino]oxypropanoic acid Traditional Name: 3-[[(E)-(3-keto-2-methyl-5-methylol-4-pyridylidene)methyl]amino]oxypropionic acid Formula: C11H14N2O5 MolecularWeight: 254.23926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=CNOCCC(=O)O)C1=O)CO

Isomeric SMILES

CC1=NC=C(/C(=C\NOCCC(=O)O)/C1=O)CO

InChI

InChI=1S/C11H14N2O5/c1-7-11(17)9(8(6-14)4-12-7)5-13-18-3-2-10(15)16/h4-5,13-14H,2-3,6H2,1H3,(H,15,16)/b9-5+