2-[4-bromanyl-2-[1-(4-bromanyl-2-chloranyl-phenyl)pyrazol-4-yl]carbonyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-bromanyl-2-[1-(4-bromanyl-2-chloranyl-phenyl)pyrazol-4-yl]carbonyl-phenoxy]ethanoic acid Openeye Name: 2-[4-bromo-2-[1-(4-bromo-2-chloro-phenyl)pyrazole-4-carbonyl]phenoxy]acetic acid CAS Name: 2-[4-bromo-2-[[1-(4-bromo-2-chlorophenyl)-4-pyrazolyl]-oxomethyl]phenoxy]acetic acid IUPAC Name: 2-[4-bromo-2-[1-(4-bromo-2-chlorophenyl)pyrazole-4-carbonyl]phenoxy]acetic acid Traditional Name: 2-[4-bromo-2-[1-(4-bromo-2-chloro-phenyl)pyrazole-4-carbonyl]phenoxy]acetic acid Formula: C18H11Br2ClN2O4 MolecularWeight: 514.55194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)Cl)N2C=C(C=N2)C(=O)C3=C(C=CC(=C3)Br)OCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Br)Cl)N2C=C(C=N2)C(=O)C3=C(C=CC(=C3)Br)OCC(=O)O

InChI

InChI=1S/C18H11Br2ClN2O4/c19-11-2-4-16(27-9-17(24)25)13(5-11)18(26)10-7-22-23(8-10)15-3-1-12(20)6-14(15)21/h1-8H,9H2,(H,24,25)