[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)imidazole-4-carboxylate

Systemtic Name: [2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)imidazole-4-carboxylate Openeye Name: [2-(1,1-diethylprop-2-ynylamino)-2-oxo-ethyl] 3-(4-fluorophenyl)imidazole-4-carboxylate CAS Name: 3-(4-fluorophenyl)-4-imidazolecarboxylic acid [2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl] 3-(4-fluorophenyl)imidazole-4-carboxylate Traditional Name: 3-(4-fluorophenyl)imidazole-4-carboxylic acid [2-(1,1-diethylprop-2-ynylamino)-2-keto-ethyl] ester Formula: C19H20FN3O3 MolecularWeight: 357.378803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20FN3O3/c1-4-19(5-2,6-3)22-17(24)12-26-18(25)16-11-21-13-23(16)15-9-7-14(20)8-10-15/h1,7-11,13H,5-6,12H2,2-3H3,(H,22,24)