5-[5-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]furan-2-yl]-2-chloranyl-benzoic acid

Systemtic Name: 5-[5-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]furan-2-yl]-2-chloranyl-benzoic acid Openeye Name: 5-[5-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-2-furyl]-2-chloro-benzoic acid CAS Name: 5-[5-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-furanyl]-2-chlorobenzoic acid IUPAC Name: 5-[5-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl]-2-chlorobenzoic acid Traditional Name: 5-[5-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]-2-furyl]-2-chloro-benzoic acid Formula: C21H12ClN3O3 MolecularWeight: 389.79128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C(=CC3=CC=C(O3)C4=CC(=C(C=C4)Cl)C(=O)O)C#N

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)/C(=C\C3=CC=C(O3)C4=CC(=C(C=C4)Cl)C(=O)O)/C#N

InChI

InChI=1S/C21H12ClN3O3/c22-16-7-5-12(10-15(16)21(26)27)19-8-6-14(28-19)9-13(11-23)20-24-17-3-1-2-4-18(17)25-20/h1-10H,(H,24,25)(H,26,27)/b13-9-