ethyl 4-(2-cyano-1-ethoxy-1-oxidanylidene-propan-2-yl)benzoate

Systemtic Name: ethyl 4-(2-cyano-1-ethoxy-1-oxidanylidene-propan-2-yl)benzoate Openeye Name: ethyl 4-(1-cyano-2-ethoxy-1-methyl-2-oxo-ethyl)benzoate CAS Name: 4-(2-cyano-1-ethoxy-1-oxopropan-2-yl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(2-cyano-1-ethoxy-1-oxopropan-2-yl)benzoate Traditional Name: 4-(1-cyano-2-ethoxy-2-keto-1-methyl-ethyl)benzoic acid ethyl ester Formula: C15H17NO4 MolecularWeight: 275.29978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17NO4/c1-4-19-13(17)11-6-8-12(9-7-11)15(3,10-16)14(18)20-5-2/h6-9H,4-5H2,1-3H3