propan-2-yl 4-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoylamino]benzoate

Systemtic Name: propan-2-yl 4-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoylamino]benzoate Openeye Name: isopropyl 4-[[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]amino]benzoate CAS Name: 4-[[2-(4-bromo-2,6-dimethylphenoxy)-1-oxoethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[2-(4-bromo-2,6-dimethylphenoxy)acetyl]amino]benzoate Traditional Name: 4-[[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]amino]benzoic acid isopropyl ester Formula: C20H22BrNO4 MolecularWeight: 420.29698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC2=CC=C(C=C2)C(=O)OC(C)C)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NC2=CC=C(C=C2)C(=O)OC(C)C)C)Br

InChI

InChI=1S/C20H22BrNO4/c1-12(2)26-20(24)15-5-7-17(8-6-15)22-18(23)11-25-19-13(3)9-16(21)10-14(19)4/h5-10,12H,11H2,1-4H3,(H,22,23)