methyl 4-(4-cyano-5-ethoxy-5-oxidanylidene-pentyl)benzoate

Systemtic Name: methyl 4-(4-cyano-5-ethoxy-5-oxidanylidene-pentyl)benzoate Openeye Name: methyl 4-(4-cyano-5-ethoxy-5-oxo-pentyl)benzoate CAS Name: 4-(4-cyano-5-ethoxy-5-oxopentyl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-cyano-5-ethoxy-5-oxopentyl)benzoate Traditional Name: 4-(4-cyano-5-ethoxy-5-keto-pentyl)benzoic acid methyl ester Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCC1=CC=C(C=C1)C(=O)OC)C#N

Isomeric SMILES

CCOC(=O)C(CCCC1=CC=C(C=C1)C(=O)OC)C#N

InChI

InChI=1S/C16H19NO4/c1-3-21-16(19)14(11-17)6-4-5-12-7-9-13(10-8-12)15(18)20-2/h7-10,14H,3-6H2,1-2H3