butyl 2-chloranyl-5-[5-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]furan-2-yl]benzoate

Systemtic Name: butyl 2-chloranyl-5-[5-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]furan-2-yl]benzoate Openeye Name: butyl 2-chloro-5-[5-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]-2-furyl]benzoate CAS Name: 2-chloro-5-[5-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-2-furanyl]benzoic acid butyl ester IUPAC Name: butyl 2-chloro-5-[5-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]furan-2-yl]benzoate Traditional Name: 2-chloro-5-[5-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]-2-furyl]benzoic acid butyl ester Formula: C26H22ClN3O3 MolecularWeight: 459.92418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)C=C(C#N)C3=NC4=C(N3)C=C(C=C4)C)Cl

Isomeric SMILES

CCCCOC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)/C=C(\C#N)/C3=NC4=C(N3)C=C(C=C4)C)Cl

InChI

InChI=1S/C26H22ClN3O3/c1-3-4-11-32-26(31)20-14-17(6-8-21(20)27)24-10-7-19(33-24)13-18(15-28)25-29-22-9-5-16(2)12-23(22)30-25/h5-10,12-14H,3-4,11H2,1-2H3,(H,29,30)/b18-13+