ethyl 4-(4-cyano-5-ethoxy-5-oxidanylidene-pentoxy)benzoate

Systemtic Name: ethyl 4-(4-cyano-5-ethoxy-5-oxidanylidene-pentoxy)benzoate Openeye Name: ethyl 4-(4-cyano-5-ethoxy-5-oxo-pentoxy)benzoate CAS Name: 4-(4-cyano-5-ethoxy-5-oxopentoxy)benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-cyano-5-ethoxy-5-oxopentoxy)benzoate Traditional Name: 4-(4-cyano-5-ethoxy-5-keto-pentoxy)benzoic acid ethyl ester Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO5/c1-3-21-16(19)13-7-9-15(10-8-13)23-11-5-6-14(12-18)17(20)22-4-2/h7-10,14H,3-6,11H2,1-2H3