ethyl 4-[2-(2-bromanyl-4-cyano-6-ethoxy-phenoxy)ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(2-bromanyl-4-cyano-6-ethoxy-phenoxy)ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(2-bromo-4-cyano-6-ethoxy-phenoxy)acetyl]amino]benzoate CAS Name: 4-[[2-(2-bromo-4-cyano-6-ethoxyphenoxy)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(2-bromo-4-cyano-6-ethoxyphenoxy)acetyl]amino]benzoate Traditional Name: 4-[[2-(2-bromo-4-cyano-6-ethoxy-phenoxy)acetyl]amino]benzoic acid ethyl ester Formula: C20H19BrN2O5 MolecularWeight: 447.27926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Br)OCC(=O)NC2=CC=C(C=C2)C(=O)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Br)OCC(=O)NC2=CC=C(C=C2)C(=O)OCC

InChI

InChI=1S/C20H19BrN2O5/c1-3-26-17-10-13(11-22)9-16(21)19(17)28-12-18(24)23-15-7-5-14(6-8-15)20(25)27-4-2/h5-10H,3-4,12H2,1-2H3,(H,23,24)