[1-ethoxy-1,3-bis(oxidanylidene)butan-2-yl] 3-cyanobenzoate

Systemtic Name: [1-ethoxy-1,3-bis(oxidanylidene)butan-2-yl] 3-cyanobenzoate Openeye Name: (1-ethoxycarbonyl-2-oxo-propyl) 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid (1-ethoxy-1,3-dioxobutan-2-yl) ester IUPAC Name: (1-ethoxy-1,3-dioxobutan-2-yl) 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid (1-carbethoxy-2-keto-propyl) ester Formula: C14H13NO5 MolecularWeight: 275.25672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13NO5/c1-3-19-14(18)12(9(2)16)20-13(17)11-6-4-5-10(7-11)8-15/h4-7,12H,3H2,1-2H3