[1-(2-chloranyl-4-fluoranyl-phenyl)-2-imidazol-1-yl-3-methoxy-3-oxidanylidene-propyl] benzoate

Systemtic Name: [1-(2-chloranyl-4-fluoranyl-phenyl)-2-imidazol-1-yl-3-methoxy-3-oxidanylidene-propyl] benzoate Openeye Name: [1-(2-chloro-4-fluoro-phenyl)-2-imidazol-1-yl-3-methoxy-3-oxo-propyl] benzoate CAS Name: benzoic acid [1-(2-chloro-4-fluorophenyl)-2-(1-imidazolyl)-3-methoxy-3-oxopropyl] ester IUPAC Name: [1-(2-chloro-4-fluorophenyl)-2-imidazol-1-yl-3-methoxy-3-oxopropyl] benzoate Traditional Name: benzoic acid [1-(2-chloro-4-fluoro-phenyl)-2-imidazol-1-yl-3-keto-3-methoxy-propyl] ester Formula: C20H16ClFN2O4 MolecularWeight: 402.803443

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C1=C(C=C(C=C1)F)Cl)OC(=O)C2=CC=CC=C2)N3C=CN=C3

Isomeric SMILES

COC(=O)C(C(C1=C(C=C(C=C1)F)Cl)OC(=O)C2=CC=CC=C2)N3C=CN=C3

InChI

InChI=1S/C20H16ClFN2O4/c1-27-20(26)17(24-10-9-23-12-24)18(15-8-7-14(22)11-16(15)21)28-19(25)13-5-3-2-4-6-13/h2-12,17-18H,1H3