methyl 2-[2-bromanyl-4-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-6-methoxy-phenoxy]ethanoate

Systemtic Name: methyl 2-[2-bromanyl-4-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-6-methoxy-phenoxy]ethanoate Openeye Name: methyl 2-[2-bromo-4-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]-6-methoxy-phenoxy]acetate CAS Name: 2-[2-bromo-4-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-6-methoxyphenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[2-bromo-4-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-6-methoxyphenoxy]acetate Traditional Name: 2-[2-bromo-4-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]-6-methoxy-phenoxy]acetic acid methyl ester Formula: C21H18BrN3O4 MolecularWeight: 456.28932

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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)OC)OC)C#N

Isomeric SMILES

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

InChI

InChI=1S/C21H18BrN3O4/c1-12-4-5-16-17(6-12)25-21(24-16)14(10-23)7-13-8-15(22)20(18(9-13)27-2)29-11-19(26)28-3/h4-9H,11H2,1-3H3,(H,24,25)