methyl 4-chloranyl-3-[[4-(2-phenylethynyl)phenyl]carbonylamino]benzoate

Systemtic Name: methyl 4-chloranyl-3-[[4-(2-phenylethynyl)phenyl]carbonylamino]benzoate Openeye Name: methyl 4-chloro-3-[[4-(2-phenylethynyl)benzoyl]amino]benzoate CAS Name: 4-chloro-3-[[oxo-[4-(2-phenylethynyl)phenyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[[4-(2-phenylethynyl)benzoyl]amino]benzoate Traditional Name: 4-chloro-3-[[4-(2-phenylethynyl)benzoyl]amino]benzoic acid methyl ester Formula: C23H16ClNO3 MolecularWeight: 389.83104

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=CC=C(C=C2)C#CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=CC=C(C=C2)C#CC3=CC=CC=C3

InChI

InChI=1S/C23H16ClNO3/c1-28-23(27)19-13-14-20(24)21(15-19)25-22(26)18-11-9-17(10-12-18)8-7-16-5-3-2-4-6-16/h2-6,9-15H,1H3,(H,25,26)