4-chloranyl-3-[5-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)ethenyl]furan-2-yl]benzoic acid

Systemtic Name: 4-chloranyl-3-[5-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)ethenyl]furan-2-yl]benzoic acid Openeye Name: 4-chloro-3-[5-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)vinyl]-2-furyl]benzoic acid CAS Name: 4-chloro-3-[5-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)ethenyl]-2-furanyl]benzoic acid IUPAC Name: 4-chloro-3-[5-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)ethenyl]furan-2-yl]benzoic acid Traditional Name: 4-chloro-3-[5-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)vinyl]-2-furyl]benzoic acid Formula: C22H14ClN3O4 MolecularWeight: 419.81726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC=C(O3)C4=C(C=CC(=C4)C(=O)O)Cl)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)/C(=C/C3=CC=C(O3)C4=C(C=CC(=C4)C(=O)O)Cl)/C#N

InChI

InChI=1S/C22H14ClN3O4/c1-29-14-3-6-18-19(10-14)26-21(25-18)13(11-24)8-15-4-7-20(30-15)16-9-12(22(27)28)2-5-17(16)23/h2-10H,1H3,(H,25,26)(H,27,28)/b13-8+