3-[5-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]furan-2-yl]-2-methyl-benzoic acid

Systemtic Name: 3-[5-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]furan-2-yl]-2-methyl-benzoic acid Openeye Name: 3-[5-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]-2-furyl]-2-methyl-benzoic acid CAS Name: 3-[5-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-2-furanyl]-2-methylbenzoic acid IUPAC Name: 3-[5-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]furan-2-yl]-2-methylbenzoic acid Traditional Name: 3-[5-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]-2-furyl]-2-methyl-benzoic acid Formula: C23H17N3O3 MolecularWeight: 383.39938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC=C(O3)C4=C(C(=CC=C4)C(=O)O)C)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC=C(O3)C4=C(C(=CC=C4)C(=O)O)C)C#N

InChI

InChI=1S/C23H17N3O3/c1-13-6-8-19-20(10-13)26-22(25-19)15(12-24)11-16-7-9-21(29-16)17-4-3-5-18(14(17)2)23(27)28/h3-11H,1-2H3,(H,25,26)(H,27,28)