methyl 4,5-dimethoxy-2-[[4-(2-phenylethynyl)phenyl]carbonylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[[4-(2-phenylethynyl)phenyl]carbonylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[[4-(2-phenylethynyl)benzoyl]amino]benzoate CAS Name: 4,5-dimethoxy-2-[[oxo-[4-(2-phenylethynyl)phenyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[[4-(2-phenylethynyl)benzoyl]amino]benzoate Traditional Name: 4,5-dimethoxy-2-[[4-(2-phenylethynyl)benzoyl]amino]benzoic acid methyl ester Formula: C25H21NO5 MolecularWeight: 415.43794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)C2=CC=C(C=C2)C#CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)C2=CC=C(C=C2)C#CC3=CC=CC=C3)OC

InChI

InChI=1S/C25H21NO5/c1-29-22-15-20(25(28)31-3)21(16-23(22)30-2)26-24(27)19-13-11-18(12-14-19)10-9-17-7-5-4-6-8-17/h4-8,11-16H,1-3H3,(H,26,27)