2-[[3,5-bis(chloranyl)-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]carbonyl-(carboxymethyl)amino]ethanoic acid

Systemtic Name: 2-[[3,5-bis(chloranyl)-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]carbonyl-(carboxymethyl)amino]ethanoic acid Openeye Name: 2-[carboxymethyl-[3,5-dichloro-4-(4-hydroxy-3-isopropyl-phenoxy)benzoyl]amino]acetic acid CAS Name: 2-[carboxymethyl-[[3,5-dichloro-4-(4-hydroxy-3-propan-2-ylphenoxy)phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[carboxymethyl-[3,5-dichloro-4-(4-hydroxy-3-propan-2-ylphenoxy)benzoyl]amino]acetic acid Traditional Name: 2-[carboxymethyl-[3,5-dichloro-4-(4-hydroxy-3-isopropyl-phenoxy)benzoyl]amino]acetic acid Formula: C20H19Cl2NO7 MolecularWeight: 456.27336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)OC2=C(C=C(C=C2Cl)C(=O)N(CC(=O)O)CC(=O)O)Cl)O

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)OC2=C(C=C(C=C2Cl)C(=O)N(CC(=O)O)CC(=O)O)Cl)O

InChI

InChI=1S/C20H19Cl2NO7/c1-10(2)13-7-12(3-4-16(13)24)30-19-14(21)5-11(6-15(19)22)20(29)23(8-17(25)26)9-18(27)28/h3-7,10,24H,8-9H2,1-2H3,(H,25,26)(H,27,28)