methyl 4-[2-acetyloxy-4-bromanyl-1,4-bis(chloranyl)-1-imidazol-1-yl-3,3-dimethyl-butoxy]benzoate

Systemtic Name: methyl 4-[2-acetyloxy-4-bromanyl-1,4-bis(chloranyl)-1-imidazol-1-yl-3,3-dimethyl-butoxy]benzoate Openeye Name: methyl 4-(2-acetoxy-4-bromo-1,4-dichloro-1-imidazol-1-yl-3,3-dimethyl-butoxy)benzoate CAS Name: 4-[2-acetyloxy-4-bromo-1,4-dichloro-1-(1-imidazolyl)-3,3-dimethylbutoxy]benzoic acid methyl ester IUPAC Name: methyl 4-(2-acetyloxy-4-bromo-1,4-dichloro-1-imidazol-1-yl-3,3-dimethylbutoxy)benzoate Traditional Name: 4-(2-acetoxy-4-bromo-1,4-dichloro-1-imidazol-1-yl-3,3-dimethyl-butoxy)benzoic acid methyl ester Formula: C19H21BrCl2N2O5 MolecularWeight: 508.19044

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C(C)(C)C(Cl)Br)C(N1C=CN=C1)(OC2=CC=C(C=C2)C(=O)OC)Cl

Isomeric SMILES

CC(=O)OC(C(C)(C)C(Cl)Br)C(N1C=CN=C1)(OC2=CC=C(C=C2)C(=O)OC)Cl

InChI

InChI=1S/C19H21BrCl2N2O5/c1-12(25)28-16(18(2,3)17(20)21)19(22,24-10-9-23-11-24)29-14-7-5-13(6-8-14)15(26)27-4/h5-11,16-17H,1-4H3