5-[2-[5-(1,3-benzodioxol-5-yl)-2-(3-methylphenyl)-1-benzofuran-3-yl]ethynyl]-1-methyl-imidazole

Systemtic Name: 5-[2-[5-(1,3-benzodioxol-5-yl)-2-(3-methylphenyl)-1-benzofuran-3-yl]ethynyl]-1-methyl-imidazole Openeye Name: 5-[2-[5-(1,3-benzodioxol-5-yl)-2-(m-tolyl)benzofuran-3-yl]ethynyl]-1-methyl-imidazole CAS Name: 5-[2-[5-(1,3-benzodioxol-5-yl)-2-(3-methylphenyl)-3-benzofuranyl]ethynyl]-1-methylimidazole IUPAC Name: 5-[2-[5-(1,3-benzodioxol-5-yl)-2-(3-methylphenyl)-1-benzofuran-3-yl]ethynyl]-1-methylimidazole Traditional Name: 5-[2-[5-(1,3-benzodioxol-5-yl)-2-(m-tolyl)benzofuran-3-yl]ethynyl]-1-methyl-imidazole Formula: C28H20N2O3 MolecularWeight: 432.47

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(C3=C(O2)C=CC(=C3)C4=CC5=C(C=C4)OCO5)C#CC6=CN=CN6C

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(C3=C(O2)C=CC(=C3)C4=CC5=C(C=C4)OCO5)C#CC6=CN=CN6C

InChI

InChI=1S/C28H20N2O3/c1-18-4-3-5-21(12-18)28-23(9-8-22-15-29-16-30(22)2)24-13-19(6-10-25(24)33-28)20-7-11-26-27(14-20)32-17-31-26/h3-7,10-16H,17H2,1-2H3