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

Systemtic Name: ethyl 5-[2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoylamino]-2-chloranyl-benzoate Openeye Name: ethyl 5-[[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]amino]-2-chloro-benzoate CAS Name: 5-[[2-(2-bromo-4-tert-butylphenoxy)-1-oxoethyl]amino]-2-chlorobenzoic acid ethyl ester IUPAC Name: ethyl 5-[[2-(2-bromo-4-tert-butylphenoxy)acetyl]amino]-2-chlorobenzoate Traditional Name: 5-[[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]amino]-2-chloro-benzoic acid ethyl ester Formula: C21H23BrClNO4 MolecularWeight: 468.76862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23BrClNO4/c1-5-27-20(26)15-11-14(7-8-17(15)23)24-19(25)12-28-18-9-6-13(10-16(18)22)21(2,3)4/h6-11H,5,12H2,1-4H3,(H,24,25)