5-bromanyl-2-[2-(3-ethylphenoxy)ethanoylamino]benzoic acid

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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