5-cyano-6-methoxy-4,6-bis(oxidanylidene)hexanoic acid

Systemtic Name: 5-cyano-6-methoxy-4,6-bis(oxidanylidene)hexanoic acid Openeye Name: 5-cyano-6-methoxy-4,6-dioxo-hexanoic acid CAS Name: 5-cyano-6-methoxy-4,6-dioxohexanoic acid IUPAC Name: 5-cyano-6-methoxy-4,6-dioxohexanoic acid Traditional Name: 5-cyano-4,6-diketo-6-methoxy-hexanoic acid Formula: C8H9NO5 MolecularWeight: 199.16076

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C#N)C(=O)CCC(=O)O

Isomeric SMILES

COC(=O)C(C#N)C(=O)CCC(=O)O

InChI

InChI=1S/C8H9NO5/c1-14-8(13)5(4-9)6(10)2-3-7(11)12/h5H,2-3H2,1H3,(H,11,12)