3-ethyl-2-(1H-imidazol-2-ylcarbonyl)octanoate

Systemtic Name: 3-ethyl-2-(1H-imidazol-2-ylcarbonyl)octanoate Openeye Name: 3-ethyl-2-(1H-imidazole-2-carbonyl)octanoate CAS Name: 3-ethyl-2-[1H-imidazol-2-yl(oxo)methyl]octanoate IUPAC Name: 3-ethyl-2-(1H-imidazole-2-carbonyl)octanoate Traditional Name: 3-ethyl-2-(1H-imidazole-2-carbonyl)caprylate Formula: C14H21N2O3- MolecularWeight: 265.32814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)C(C(=O)C1=NC=CN1)C(=O)[O-]

Isomeric SMILES

CCCCCC(CC)C(C(=O)C1=NC=CN1)C(=O)[O-]

InChI

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