methyl 4-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoylamino]-5-chloranyl-2-methoxy-benzoate

Systemtic Name: methyl 4-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoylamino]-5-chloranyl-2-methoxy-benzoate Openeye Name: methyl 4-[[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]-5-chloro-2-methoxy-benzoate CAS Name: 4-[[2-(4-bromo-2-tert-butylphenoxy)-1-oxoethyl]amino]-5-chloro-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-bromo-2-tert-butylphenoxy)acetyl]amino]-5-chloro-2-methoxybenzoate Traditional Name: 4-[[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]-5-chloro-2-methoxy-benzoic acid methyl ester Formula: C21H23BrClNO5 MolecularWeight: 484.76802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)Br)OCC(=O)NC2=C(C=C(C(=C2)OC)C(=O)OC)Cl

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)Br)OCC(=O)NC2=C(C=C(C(=C2)OC)C(=O)OC)Cl

InChI

InChI=1S/C21H23BrClNO5/c1-21(2,3)14-8-12(22)6-7-17(14)29-11-19(25)24-16-10-18(27-4)13(9-15(16)23)20(26)28-5/h6-10H,11H2,1-5H3,(H,24,25)