methyl 4-(1-cyano-2-ethoxy-2-oxidanylidene-ethyl)benzoate

Systemtic Name: methyl 4-(1-cyano-2-ethoxy-2-oxidanylidene-ethyl)benzoate Openeye Name: methyl 4-(1-cyano-2-ethoxy-2-oxo-ethyl)benzoate CAS Name: 4-(1-cyano-2-ethoxy-2-oxoethyl)benzoic acid methyl ester IUPAC Name: methyl 4-(1-cyano-2-ethoxy-2-oxoethyl)benzoate Traditional Name: 4-(1-cyano-2-ethoxy-2-keto-ethyl)benzoic acid methyl ester Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO4/c1-3-18-13(16)11(8-14)9-4-6-10(7-5-9)12(15)17-2/h4-7,11H,3H2,1-2H3