2-[2-bromanyl-6-chloranyl-4-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]phenoxy]ethanoic acid

Systemtic Name: 2-[2-bromanyl-6-chloranyl-4-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]phenoxy]ethanoic acid Openeye Name: 2-[2-bromo-6-chloro-4-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]phenoxy]acetic acid CAS Name: 2-[2-bromo-6-chloro-4-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]phenoxy]acetic acid IUPAC Name: 2-[2-bromo-6-chloro-4-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]phenoxy]acetic acid Traditional Name: 2-[2-bromo-6-chloro-4-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]phenoxy]acetic acid Formula: C19H13BrClN3O3 MolecularWeight: 446.68182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC(=C(C(=C3)Br)OCC(=O)O)Cl)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)/C(=C/C3=CC(=C(C(=C3)Br)OCC(=O)O)Cl)/C#N

InChI

InChI=1S/C19H13BrClN3O3/c1-10-2-3-15-16(4-10)24-19(23-15)12(8-22)5-11-6-13(20)18(14(21)7-11)27-9-17(25)26/h2-7H,9H2,1H3,(H,23,24)(H,25,26)/b12-5+