5-bromanyl-2-[2-(2,6-dimethylphenoxy)ethanoylamino]benzoic acid

Systemtic Name: 5-bromanyl-2-[2-(2,6-dimethylphenoxy)ethanoylamino]benzoic acid Openeye Name: 5-bromo-2-[[2-(2,6-dimethylphenoxy)acetyl]amino]benzoic acid CAS Name: 5-bromo-2-[[2-(2,6-dimethylphenoxy)-1-oxoethyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[[2-(2,6-dimethylphenoxy)acetyl]amino]benzoic acid Traditional Name: 5-bromo-2-[[2-(2,6-dimethylphenoxy)acetyl]amino]benzoic acid Formula: C17H16BrNO4 MolecularWeight: 378.21724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC(=O)NC2=C(C=C(C=C2)Br)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC(=O)NC2=C(C=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C17H16BrNO4/c1-10-4-3-5-11(2)16(10)23-9-15(20)19-14-7-6-12(18)8-13(14)17(21)22/h3-8H,9H2,1-2H3,(H,19,20)(H,21,22)