methyl 6-[2,4-dicyano-5-(6-methoxy-6-oxidanylidene-hexyl)phenyl]hexanoate

Systemtic Name: methyl 6-[2,4-dicyano-5-(6-methoxy-6-oxidanylidene-hexyl)phenyl]hexanoate Openeye Name: methyl 6-[2,4-dicyano-5-(6-methoxy-6-oxo-hexyl)phenyl]hexanoate CAS Name: 6-[2,4-dicyano-5-(6-methoxy-6-oxohexyl)phenyl]hexanoic acid methyl ester IUPAC Name: methyl 6-[2,4-dicyano-5-(6-methoxy-6-oxohexyl)phenyl]hexanoate Traditional Name: 6-[2,4-dicyano-5-(6-keto-6-methoxy-hexyl)phenyl]hexanoic acid methyl ester Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCC1=CC(=C(C=C1C#N)C#N)CCCCCC(=O)OC

Isomeric SMILES

COC(=O)CCCCCC1=CC(=C(C=C1C#N)C#N)CCCCCC(=O)OC

InChI

InChI=1S/C22H28N2O4/c1-27-21(25)11-7-3-5-9-17-13-18(20(16-24)14-19(17)15-23)10-6-4-8-12-22(26)28-2/h13-14H,3-12H2,1-2H3