(E)-2-azanyloxy-6-(4-chlorophenyl)-8-(4-fluorophenyl)-7-imidazol-1-yl-oct-5-enoic acid

Systemtic Name: (E)-2-azanyloxy-6-(4-chlorophenyl)-8-(4-fluorophenyl)-7-imidazol-1-yl-oct-5-enoic acid Openeye Name: (E)-2-aminooxy-6-(4-chlorophenyl)-8-(4-fluorophenyl)-7-imidazol-1-yl-oct-5-enoic acid CAS Name: (E)-2-aminooxy-6-(4-chlorophenyl)-8-(4-fluorophenyl)-7-(1-imidazolyl)-5-octenoic acid IUPAC Name: (E)-2-aminooxy-6-(4-chlorophenyl)-8-(4-fluorophenyl)-7-imidazol-1-yloct-5-enoic acid Traditional Name: (E)-2-aminooxy-6-(4-chlorophenyl)-8-(4-fluorophenyl)-7-imidazol-1-yl-oct-5-enoic acid Formula: C23H23ClFN3O3 MolecularWeight: 443.898423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=CCCC(C(=O)O)ON)C2=CC=C(C=C2)Cl)N3C=CN=C3)F

Isomeric SMILES

C1=CC(=CC=C1CC(/C(=C/CCC(C(=O)O)ON)/C2=CC=C(C=C2)Cl)N3C=CN=C3)F

InChI

InChI=1S/C23H23ClFN3O3/c24-18-8-6-17(7-9-18)20(2-1-3-22(31-26)23(29)30)21(28-13-12-27-15-28)14-16-4-10-19(25)11-5-16/h2,4-13,15,21-22H,1,3,14,26H2,(H,29,30)/b20-2+