2-[4-[2-(2-bromanyl-4,6-dimethyl-phenoxy)ethanoylamino]phenyl]ethanoic acid

Systemtic Name: 2-[4-[2-(2-bromanyl-4,6-dimethyl-phenoxy)ethanoylamino]phenyl]ethanoic acid Openeye Name: 2-[4-[[2-(2-bromo-4,6-dimethyl-phenoxy)acetyl]amino]phenyl]acetic acid CAS Name: 2-[4-[[2-(2-bromo-4,6-dimethylphenoxy)-1-oxoethyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-[[2-(2-bromo-4,6-dimethylphenoxy)acetyl]amino]phenyl]acetic acid Traditional Name: 2-[4-[[2-(2-bromo-4,6-dimethyl-phenoxy)acetyl]amino]phenyl]acetic acid Formula: C18H18BrNO4 MolecularWeight: 392.24382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrNO4/c1-11-7-12(2)18(15(19)8-11)24-10-16(21)20-14-5-3-13(4-6-14)9-17(22)23/h3-8H,9-10H2,1-2H3,(H,20,21)(H,22,23)