methyl 5-bromanyl-2-[2-(4-tert-butylphenoxy)ethanoylamino]benzoate

Systemtic Name: methyl 5-bromanyl-2-[2-(4-tert-butylphenoxy)ethanoylamino]benzoate Openeye Name: methyl 5-bromo-2-[[2-(4-tert-butylphenoxy)acetyl]amino]benzoate CAS Name: 5-bromo-2-[[2-(4-tert-butylphenoxy)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[[2-(4-tert-butylphenoxy)acetyl]amino]benzoate Traditional Name: 5-bromo-2-[[2-(4-tert-butylphenoxy)acetyl]amino]benzoic acid methyl ester Formula: C20H22BrNO4 MolecularWeight: 420.29698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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