ethyl 1-[3,5-bis(chloranyl)phenyl]-5-[1,3-bis(4-fluorophenyl)-1-oxidanylidene-propan-2-yl]imidazole-4-carboxylate

Systemtic Name: ethyl 1-[3,5-bis(chloranyl)phenyl]-5-[1,3-bis(4-fluorophenyl)-1-oxidanylidene-propan-2-yl]imidazole-4-carboxylate Openeye Name: ethyl 1-(3,5-dichlorophenyl)-5-[2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-2-oxo-ethyl]imidazole-4-carboxylate CAS Name: 5-[1,3-bis(4-fluorophenyl)-1-oxopropan-2-yl]-1-(3,5-dichlorophenyl)-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[1,3-bis(4-fluorophenyl)-1-oxopropan-2-yl]-1-(3,5-dichlorophenyl)imidazole-4-carboxylate Traditional Name: 1-(3,5-dichlorophenyl)-5-[1-(4-fluorobenzyl)-2-(4-fluorophenyl)-2-keto-ethyl]imidazole-4-carboxylic acid ethyl ester Formula: C27H20Cl2F2N2O3 MolecularWeight: 529.362106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C=N1)C2=CC(=CC(=C2)Cl)Cl)C(CC3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1=C(N(C=N1)C2=CC(=CC(=C2)Cl)Cl)C(CC3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H20Cl2F2N2O3/c1-2-36-27(35)24-25(33(15-32-24)22-13-18(28)12-19(29)14-22)23(11-16-3-7-20(30)8-4-16)26(34)17-5-9-21(31)10-6-17/h3-10,12-15,23H,2,11H2,1H3