ethyl 3-[2-(2-bromanyl-4-ethyl-phenoxy)ethanoyl-(phenylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[2-(2-bromanyl-4-ethyl-phenoxy)ethanoyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-[benzyl-[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]propanoate CAS Name: 3-[[2-(2-bromo-4-ethylphenoxy)-1-oxoethyl]-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl-[2-(2-bromo-4-ethylphenoxy)acetyl]amino]propanoate Traditional Name: 3-[benzyl-[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]propionic acid ethyl ester Formula: C22H26BrNO4 MolecularWeight: 448.35014

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)N(CCC(=O)OCC)CC2=CC=CC=C2)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)N(CCC(=O)OCC)CC2=CC=CC=C2)Br

InChI

InChI=1S/C22H26BrNO4/c1-3-17-10-11-20(19(23)14-17)28-16-21(25)24(13-12-22(26)27-4-2)15-18-8-6-5-7-9-18/h5-11,14H,3-4,12-13,15-16H2,1-2H3