2-[4-(4-acetamido-3-bromanyl-phenoxy)-3,5-bis(chloranyl)phenyl]ethanoic acid

Systemtic Name: 2-[4-(4-acetamido-3-bromanyl-phenoxy)-3,5-bis(chloranyl)phenyl]ethanoic acid Openeye Name: 2-[4-(4-acetamido-3-bromo-phenoxy)-3,5-dichloro-phenyl]acetic acid CAS Name: 2-[4-(4-acetamido-3-bromophenoxy)-3,5-dichlorophenyl]acetic acid IUPAC Name: 2-[4-(4-acetamido-3-bromophenoxy)-3,5-dichlorophenyl]acetic acid Traditional Name: 2-[4-(4-acetamido-3-bromo-phenoxy)-3,5-dichloro-phenyl]acetic acid Formula: C16H12BrCl2NO4 MolecularWeight: 433.08078

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)OC2=C(C=C(C=C2Cl)CC(=O)O)Cl)Br

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)OC2=C(C=C(C=C2Cl)CC(=O)O)Cl)Br

InChI

InChI=1S/C16H12BrCl2NO4/c1-8(21)20-14-3-2-10(7-11(14)17)24-16-12(18)4-9(5-13(16)19)6-15(22)23/h2-5,7H,6H2,1H3,(H,20,21)(H,22,23)