2-[3-[(4-bromophenyl)sulfonylamino]-4-(2-methoxycarbonylphenoxy)phenyl]ethanoic acid

Systemtic Name: 2-[3-[(4-bromophenyl)sulfonylamino]-4-(2-methoxycarbonylphenoxy)phenyl]ethanoic acid Openeye Name: 2-[3-[(4-bromophenyl)sulfonylamino]-4-(2-methoxycarbonylphenoxy)phenyl]acetic acid CAS Name: 2-[3-[(4-bromophenyl)sulfonylamino]-4-(2-methoxycarbonylphenoxy)phenyl]acetic acid IUPAC Name: 2-[3-[(4-bromophenyl)sulfonylamino]-4-(2-methoxycarbonylphenoxy)phenyl]acetic acid Traditional Name: 2-[3-(brosylamino)-4-(2-carbomethoxyphenoxy)phenyl]acetic acid Formula: C22H18BrNO7S MolecularWeight: 520.34982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1OC2=C(C=C(C=C2)CC(=O)O)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

COC(=O)C1=CC=CC=C1OC2=C(C=C(C=C2)CC(=O)O)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H18BrNO7S/c1-30-22(27)17-4-2-3-5-19(17)31-20-11-6-14(13-21(25)26)12-18(20)24-32(28,29)16-9-7-15(23)8-10-16/h2-12,24H,13H2,1H3,(H,25,26)