2-[2-[(4-bromophenyl)methyl-fluoranyl-carbamoyl]-5-methylsulfanyl-phenoxy]ethanoic acid

Systemtic Name: 2-[2-[(4-bromophenyl)methyl-fluoranyl-carbamoyl]-5-methylsulfanyl-phenoxy]ethanoic acid Openeye Name: 2-[2-[(4-bromophenyl)methyl-fluoro-carbamoyl]-5-methylsulfanyl-phenoxy]acetic acid CAS Name: 2-[2-[[(4-bromophenyl)methyl-fluoroamino]-oxomethyl]-5-(methylthio)phenoxy]acetic acid IUPAC Name: 2-[2-[(4-bromophenyl)methyl-fluorocarbamoyl]-5-methylsulfanylphenoxy]acetic acid Traditional Name: 2-[2-[(4-bromobenzyl)-fluoro-carbamoyl]-5-(methylthio)phenoxy]acetic acid Formula: C17H15BrFNO4S MolecularWeight: 428.272703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)C(=O)N(CC2=CC=C(C=C2)Br)F)OCC(=O)O

Isomeric SMILES

CSC1=CC(=C(C=C1)C(=O)N(CC2=CC=C(C=C2)Br)F)OCC(=O)O

InChI

InChI=1S/C17H15BrFNO4S/c1-25-13-6-7-14(15(8-13)24-10-16(21)22)17(23)20(19)9-11-2-4-12(18)5-3-11/h2-8H,9-10H2,1H3,(H,21,22)