[2-[ethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)imidazole-4-carboxylate

Systemtic Name: [2-[ethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)imidazole-4-carboxylate Openeye Name: [2-[benzyl(ethyl)amino]-2-oxo-ethyl] 3-(4-fluorophenyl)imidazole-4-carboxylate CAS Name: 3-(4-fluorophenyl)-4-imidazolecarboxylic acid [2-[ethyl-(phenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[benzyl(ethyl)amino]-2-oxoethyl] 3-(4-fluorophenyl)imidazole-4-carboxylate Traditional Name: 3-(4-fluorophenyl)imidazole-4-carboxylic acid [2-[benzyl(ethyl)amino]-2-keto-ethyl] ester Formula: C21H20FN3O3 MolecularWeight: 381.400203

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)COC(=O)C2=CN=CN2C3=CC=C(C=C3)F

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)COC(=O)C2=CN=CN2C3=CC=C(C=C3)F

InChI

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