2-cyano-4-ethoxycarbonyl-5-oxidanylidene-5-phenyl-pentanoic acid

Systemtic Name: 2-cyano-4-ethoxycarbonyl-5-oxidanylidene-5-phenyl-pentanoic acid Openeye Name: 4-benzoyl-2-cyano-5-ethoxy-5-oxo-pentanoic acid CAS Name: 4-benzoyl-2-cyano-5-ethoxy-5-oxopentanoic acid IUPAC Name: 4-benzoyl-2-cyano-5-ethoxy-5-oxopentanoic acid Traditional Name: 4-benzoyl-2-cyano-5-ethoxy-5-keto-valeric acid Formula: C15H15NO5 MolecularWeight: 289.2833

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C#N)C(=O)O)C(=O)C1=CC=CC=C1

Isomeric SMILES

CCOC(=O)C(CC(C#N)C(=O)O)C(=O)C1=CC=CC=C1

InChI

InChI=1S/C15H15NO5/c1-2-21-15(20)12(8-11(9-16)14(18)19)13(17)10-6-4-3-5-7-10/h3-7,11-12H,2,8H2,1H3,(H,18,19)