propan-2-yl 4-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoylamino]benzoate

Systemtic Name: propan-2-yl 4-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoylamino]benzoate Openeye Name: isopropyl 4-[[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]benzoate CAS Name: 4-[[2-(4-bromo-2-tert-butylphenoxy)-1-oxoethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[2-(4-bromo-2-tert-butylphenoxy)acetyl]amino]benzoate Traditional Name: 4-[[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]benzoic acid isopropyl ester Formula: C22H26BrNO4 MolecularWeight: 448.35014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)Br)C(C)(C)C

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)Br)C(C)(C)C

InChI

InChI=1S/C22H26BrNO4/c1-14(2)28-21(26)15-6-9-17(10-7-15)24-20(25)13-27-19-11-8-16(23)12-18(19)22(3,4)5/h6-12,14H,13H2,1-5H3,(H,24,25)