5-bromanyl-2-[2-(3,4-dimethylphenoxy)ethanoylamino]benzoic acid

Systemtic Name: 5-bromanyl-2-[2-(3,4-dimethylphenoxy)ethanoylamino]benzoic acid Openeye Name: 5-bromo-2-[[2-(3,4-dimethylphenoxy)acetyl]amino]benzoic acid CAS Name: 5-bromo-2-[[2-(3,4-dimethylphenoxy)-1-oxoethyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[[2-(3,4-dimethylphenoxy)acetyl]amino]benzoic acid Traditional Name: 5-bromo-2-[[2-(3,4-dimethylphenoxy)acetyl]amino]benzoic acid Formula: C17H16BrNO4 MolecularWeight: 378.21724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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