5-[(2-ethoxycarbonylaziridin-1-yl)methyl]-6-oxidanylidene-1H-pyridine-2-carboxylic acid

Systemtic Name: 5-[(2-ethoxycarbonylaziridin-1-yl)methyl]-6-oxidanylidene-1H-pyridine-2-carboxylic acid Openeye Name: 5-[(2-ethoxycarbonylaziridin-1-yl)methyl]-6-oxo-1H-pyridine-2-carboxylic acid CAS Name: 5-[(2-ethoxycarbonyl-1-aziridinyl)methyl]-6-oxo-1H-pyridine-2-carboxylic acid IUPAC Name: 5-[(2-ethoxycarbonylaziridin-1-yl)methyl]-6-oxo-1H-pyridine-2-carboxylic acid Traditional Name: 5-[(2-carbethoxyethylenimin-1-yl)methyl]-6-keto-1H-pyridine-2-carboxylic acid Formula: C12H14N2O5 MolecularWeight: 266.24996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CN1CC2=CC=C(NC2=O)C(=O)O

Isomeric SMILES

CCOC(=O)C1CN1CC2=CC=C(NC2=O)C(=O)O

InChI

InChI=1S/C12H14N2O5/c1-2-19-12(18)9-6-14(9)5-7-3-4-8(11(16)17)13-10(7)15/h3-4,9H,2,5-6H2,1H3,(H,13,15)(H,16,17)