methyl 4-[2-(2-bromanyl-4-butan-2-yl-phenoxy)ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(2-bromanyl-4-butan-2-yl-phenoxy)ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(2-bromo-4-sec-butyl-phenoxy)acetyl]amino]benzoate CAS Name: 4-[[2-(2-bromo-4-butan-2-ylphenoxy)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(2-bromo-4-butan-2-ylphenoxy)acetyl]amino]benzoate Traditional Name: 4-[[2-(2-bromo-4-sec-butyl-phenoxy)acetyl]amino]benzoic acid methyl ester Formula: C20H22BrNO4 MolecularWeight: 420.29698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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