ethyl 4-[3-(1-cyano-2-ethoxy-2-oxidanylidene-ethyl)hex-5-enyl]benzoate

Systemtic Name: ethyl 4-[3-(1-cyano-2-ethoxy-2-oxidanylidene-ethyl)hex-5-enyl]benzoate Openeye Name: ethyl 4-[3-(1-cyano-2-ethoxy-2-oxo-ethyl)hex-5-enyl]benzoate CAS Name: 4-[3-(1-cyano-2-ethoxy-2-oxoethyl)hex-5-enyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(1-cyano-2-ethoxy-2-oxoethyl)hex-5-enyl]benzoate Traditional Name: 4-[3-(1-cyano-2-ethoxy-2-keto-ethyl)hex-5-enyl]benzoic acid ethyl ester Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25NO4/c1-4-7-16(18(14-21)20(23)25-6-3)11-8-15-9-12-17(13-10-15)19(22)24-5-2/h4,9-10,12-13,16,18H,1,5-8,11H2,2-3H3