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

Systemtic Name: ethyl 4-[2-(2-bromanyl-4-butan-2-yl-phenoxy)ethanoylamino]benzoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C21H24BrNO4 MolecularWeight: 434.32356

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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)OCC)Br

Isomeric SMILES

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

InChI

InChI=1S/C21H24BrNO4/c1-4-14(3)16-8-11-19(18(22)12-16)27-13-20(24)23-17-9-6-15(7-10-17)21(25)26-5-2/h6-12,14H,4-5,13H2,1-3H3,(H,23,24)