[2-oxidanylidene-2-[phenyl(propan-2-yl)amino]ethyl] 3-(4-fluorophenyl)imidazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[phenyl(propan-2-yl)amino]ethyl] 3-(4-fluorophenyl)imidazole-4-carboxylate Openeye Name: [2-(N-isopropylanilino)-2-oxo-ethyl] 3-(4-fluorophenyl)imidazole-4-carboxylate CAS Name: 3-(4-fluorophenyl)-4-imidazolecarboxylic acid [2-oxo-2-(N-propan-2-ylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(N-propan-2-ylanilino)ethyl] 3-(4-fluorophenyl)imidazole-4-carboxylate Traditional Name: 3-(4-fluorophenyl)imidazole-4-carboxylic acid [2-(N-isopropylanilino)-2-keto-ethyl] ester Formula: C21H20FN3O3 MolecularWeight: 381.400203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C(=O)COC(=O)C2=CN=CN2C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C(=O)COC(=O)C2=CN=CN2C3=CC=C(C=C3)F

InChI

InChI=1S/C21H20FN3O3/c1-15(2)25(18-6-4-3-5-7-18)20(26)13-28-21(27)19-12-23-14-24(19)17-10-8-16(22)9-11-17/h3-12,14-15H,13H2,1-2H3