[4-[4-(4-chlorophenyl)phenoxy]-4-imidazol-1-yl-2,2-dimethyl-3-oxidanylidene-butyl] 2-acetamidoethanoate

Systemtic Name: [4-[4-(4-chlorophenyl)phenoxy]-4-imidazol-1-yl-2,2-dimethyl-3-oxidanylidene-butyl] 2-acetamidoethanoate Openeye Name: [4-[4-(4-chlorophenyl)phenoxy]-4-imidazol-1-yl-2,2-dimethyl-3-oxo-butyl] 2-acetamidoacetate CAS Name: 2-acetamidoacetic acid [4-[4-(4-chlorophenyl)phenoxy]-4-(1-imidazolyl)-2,2-dimethyl-3-oxobutyl] ester IUPAC Name: [4-[4-(4-chlorophenyl)phenoxy]-4-imidazol-1-yl-2,2-dimethyl-3-oxobutyl] 2-acetamidoacetate Traditional Name: 2-acetamidoacetic acid [4-[4-(4-chlorophenyl)phenoxy]-4-imidazol-1-yl-3-keto-2,2-dimethyl-butyl] ester Formula: C25H26ClN3O5 MolecularWeight: 483.94404

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC(=O)OCC(C)(C)C(=O)C(N1C=CN=C1)OC2=CC=C(C=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)NCC(=O)OCC(C)(C)C(=O)C(N1C=CN=C1)OC2=CC=C(C=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H26ClN3O5/c1-17(30)28-14-22(31)33-15-25(2,3)23(32)24(29-13-12-27-16-29)34-21-10-6-19(7-11-21)18-4-8-20(26)9-5-18/h4-13,16,24H,14-15H2,1-3H3,(H,28,30)