3-methyl-N'-[4-(2-phenylethynyl)phenyl]carbonyl-1-benzofuran-2-carbohydrazide

Systemtic Name: 3-methyl-N'-[4-(2-phenylethynyl)phenyl]carbonyl-1-benzofuran-2-carbohydrazide Openeye Name: 3-methyl-N'-[4-(2-phenylethynyl)benzoyl]benzofuran-2-carbohydrazide CAS Name: 3-methyl-N'-[oxo-[4-(2-phenylethynyl)phenyl]methyl]-2-benzofurancarbohydrazide IUPAC Name: 3-methyl-N'-[4-(2-phenylethynyl)benzoyl]-1-benzofuran-2-carbohydrazide Traditional Name: 3-methyl-N'-[4-(2-phenylethynyl)benzoyl]coumarilohydrazide Formula: C25H18N2O3 MolecularWeight: 394.42202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NNC(=O)C3=CC=C(C=C3)C#CC4=CC=CC=C4

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NNC(=O)C3=CC=C(C=C3)C#CC4=CC=CC=C4

InChI

InChI=1S/C25H18N2O3/c1-17-21-9-5-6-10-22(21)30-23(17)25(29)27-26-24(28)20-15-13-19(14-16-20)12-11-18-7-3-2-4-8-18/h2-10,13-16H,1H3,(H,26,28)(H,27,29)