pentyl 4-[2-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)ethanoylamino]benzoate

Systemtic Name: pentyl 4-[2-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)ethanoylamino]benzoate Openeye Name: pentyl 4-[[2-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)acetyl]amino]benzoate CAS Name: 4-[[2-(2-bromo-4-chloro-3,5-dimethylphenoxy)-1-oxoethyl]amino]benzoic acid pentyl ester IUPAC Name: pentyl 4-[[2-(2-bromo-4-chloro-3,5-dimethylphenoxy)acetyl]amino]benzoate Traditional Name: 4-[[2-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)acetyl]amino]benzoic acid amyl ester Formula: C22H25BrClNO4 MolecularWeight: 482.7952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=C(C(=C(C(=C2)C)Cl)C)Br

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=C(C(=C(C(=C2)C)Cl)C)Br

InChI

InChI=1S/C22H25BrClNO4/c1-4-5-6-11-28-22(27)16-7-9-17(10-8-16)25-19(26)13-29-18-12-14(2)21(24)15(3)20(18)23/h7-10,12H,4-6,11,13H2,1-3H3,(H,25,26)