3-azanylidene-4-cyano-5-ethoxy-5-oxidanylidene-pentanoic acid

Systemtic Name: 3-azanylidene-4-cyano-5-ethoxy-5-oxidanylidene-pentanoic acid Openeye Name: 4-cyano-5-ethoxy-3-imino-5-oxo-pentanoic acid CAS Name: 4-cyano-5-ethoxy-3-imino-5-oxopentanoic acid IUPAC Name: 4-cyano-5-ethoxy-3-imino-5-oxopentanoic acid Traditional Name: 4-cyano-5-ethoxy-3-imino-5-keto-valeric acid Formula: C8H10N2O4 MolecularWeight: 198.176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C(=N)CC(=O)O

Isomeric SMILES

CCOC(=O)C(C#N)C(=N)CC(=O)O

InChI

InChI=1S/C8H10N2O4/c1-2-14-8(13)5(4-9)6(10)3-7(11)12/h5,10H,2-3H2,1H3,(H,11,12)