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

Systemtic Name: 3-[5-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]furan-2-yl]-4-methyl-benzoic acid Openeye Name: 3-[5-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]-2-furyl]-4-methyl-benzoic acid CAS Name: 3-[5-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-2-furanyl]-4-methylbenzoic acid IUPAC Name: 3-[5-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]furan-2-yl]-4-methylbenzoic acid Traditional Name: 3-[5-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]-2-furyl]-4-methyl-benzoic acid Formula: C23H17N3O3 MolecularWeight: 383.39938

Click to see the large picture

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