hexyl (5E)-5-(2-oxidanylideneimidazol-4-ylidene)pentanoate

Systemtic Name: hexyl (5E)-5-(2-oxidanylideneimidazol-4-ylidene)pentanoate Openeye Name: hexyl (5E)-5-(2-oxoimidazol-4-ylidene)pentanoate CAS Name: (5E)-5-(2-oxo-4-imidazolylidene)pentanoic acid hexyl ester IUPAC Name: hexyl (5E)-5-(2-oxoimidazol-4-ylidene)pentanoate Traditional Name: (5E)-5-(2-keto-3-imidazolin-4-ylidene)valeric acid hexyl ester Formula: C14H22N2O3 MolecularWeight: 266.33608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CCCC=C1C=NC(=O)N1

Isomeric SMILES

CCCCCCOC(=O)CCC/C=C/1\C=NC(=O)N1

InChI

InChI=1S/C14H22N2O3/c1-2-3-4-7-10-19-13(17)9-6-5-8-12-11-15-14(18)16-12/h8,11H,2-7,9-10H2,1H3,(H,16,18)/b12-8+