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

Systemtic Name: 2-methylpropyl 4-[2-(4-bromanyl-2-ethyl-phenoxy)ethanoylamino]benzoate Openeye Name: isobutyl 4-[[2-(4-bromo-2-ethyl-phenoxy)acetyl]amino]benzoate CAS Name: 4-[[2-(4-bromo-2-ethylphenoxy)-1-oxoethyl]amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[[2-(4-bromo-2-ethylphenoxy)acetyl]amino]benzoate Traditional Name: 4-[[2-(4-bromo-2-ethyl-phenoxy)acetyl]amino]benzoic acid isobutyl ester Formula: C21H24BrNO4 MolecularWeight: 434.32356

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)OCC(=O)NC2=CC=C(C=C2)C(=O)OCC(C)C

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)OCC(=O)NC2=CC=C(C=C2)C(=O)OCC(C)C

InChI

InChI=1S/C21H24BrNO4/c1-4-15-11-17(22)7-10-19(15)26-13-20(24)23-18-8-5-16(6-9-18)21(25)27-12-14(2)3/h5-11,14H,4,12-13H2,1-3H3,(H,23,24)