[2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 3-(4-fluorophenyl)imidazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 3-(4-fluorophenyl)imidazole-4-carboxylate Openeye Name: [2-(1-methylbutylamino)-2-oxo-ethyl] 3-(4-fluorophenyl)imidazole-4-carboxylate CAS Name: 3-(4-fluorophenyl)-4-imidazolecarboxylic acid [2-oxo-2-(pentan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-2-ylamino)ethyl] 3-(4-fluorophenyl)imidazole-4-carboxylate Traditional Name: 3-(4-fluorophenyl)imidazole-4-carboxylic acid [2-keto-2-(1-methylbutylamino)ethyl] ester Formula: C17H20FN3O3 MolecularWeight: 333.357403

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C1=CN=CN1C2=CC=C(C=C2)F

Isomeric SMILES

CCCC(C)NC(=O)COC(=O)C1=CN=CN1C2=CC=C(C=C2)F

InChI

InChI=1S/C17H20FN3O3/c1-3-4-12(2)20-16(22)10-24-17(23)15-9-19-11-21(15)14-7-5-13(18)6-8-14/h5-9,11-12H,3-4,10H2,1-2H3,(H,20,22)