5-bromanyl-2-[2-(2-butan-2-ylphenoxy)ethanoylamino]benzoic acid

Systemtic Name: 5-bromanyl-2-[2-(2-butan-2-ylphenoxy)ethanoylamino]benzoic acid Openeye Name: 5-bromo-2-[[2-(2-sec-butylphenoxy)acetyl]amino]benzoic acid CAS Name: 5-bromo-2-[[2-(2-butan-2-ylphenoxy)-1-oxoethyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[[2-(2-butan-2-ylphenoxy)acetyl]amino]benzoic acid Traditional Name: 5-bromo-2-[[2-(2-sec-butylphenoxy)acetyl]amino]benzoic acid Formula: C19H20BrNO4 MolecularWeight: 406.2704

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCC(=O)NC2=C(C=C(C=C2)Br)C(=O)O

Isomeric SMILES

CCC(C)C1=CC=CC=C1OCC(=O)NC2=C(C=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C19H20BrNO4/c1-3-12(2)14-6-4-5-7-17(14)25-11-18(22)21-16-9-8-13(20)10-15(16)19(23)24/h4-10,12H,3,11H2,1-2H3,(H,21,22)(H,23,24)