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

Systemtic Name: ethyl 5-[5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]furan-2-yl]-2-chloranyl-benzoate Openeye Name: ethyl 5-[5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-2-furyl]-2-chloro-benzoate CAS Name: 5-[5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-furanyl]-2-chlorobenzoic acid ethyl ester IUPAC Name: ethyl 5-[5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl]-2-chlorobenzoate Traditional Name: 5-[5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-2-furyl]-2-chloro-benzoic acid ethyl ester Formula: C23H16ClN3O3 MolecularWeight: 417.84444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)C=C(C#N)C3=NC4=CC=CC=C4N3)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)/C=C(\C#N)/C3=NC4=CC=CC=C4N3)Cl

InChI

InChI=1S/C23H16ClN3O3/c1-2-29-23(28)17-12-14(7-9-18(17)24)21-10-8-16(30-21)11-15(13-25)22-26-19-5-3-4-6-20(19)27-22/h3-12H,2H2,1H3,(H,26,27)/b15-11+