2-[[4-[2-(4-bromanyl-2-chloranyl-6-methyl-phenoxy)ethanoylamino]phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[4-[2-(4-bromanyl-2-chloranyl-6-methyl-phenoxy)ethanoylamino]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[4-[[2-(4-bromo-2-chloro-6-methyl-phenoxy)acetyl]amino]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[4-[[2-(4-bromo-2-chloro-6-methylphenoxy)-1-oxoethyl]amino]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[4-[[2-(4-bromo-2-chloro-6-methylphenoxy)acetyl]amino]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[4-[[2-(4-bromo-2-chloro-6-methyl-phenoxy)acetyl]amino]phenyl]sulfonylamino]acetic acid Formula: C17H16BrClN2O6S MolecularWeight: 491.74074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC(=O)O)Cl)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC(=O)O)Cl)Br

InChI

InChI=1S/C17H16BrClN2O6S/c1-10-6-11(18)7-14(19)17(10)27-9-15(22)21-12-2-4-13(5-3-12)28(25,26)20-8-16(23)24/h2-7,20H,8-9H2,1H3,(H,21,22)(H,23,24)