4-[[4-(2-phenylethynyl)phenyl]methylideneamino]benzoate

Systemtic Name: 4-[[4-(2-phenylethynyl)phenyl]methylideneamino]benzoate Openeye Name: 4-[[4-(2-phenylethynyl)phenyl]methyleneamino]benzoate CAS Name: 4-[[4-(2-phenylethynyl)phenyl]methylideneamino]benzoate IUPAC Name: 4-[[4-(2-phenylethynyl)phenyl]methylideneamino]benzoate Traditional Name: 4-[[4-(2-phenylethynyl)benzylidene]amino]benzoate Formula: C22H14NO2- MolecularWeight: 324.35206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C=NC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C=NC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C22H15NO2/c24-22(25)20-12-14-21(15-13-20)23-16-19-10-8-18(9-11-19)7-6-17-4-2-1-3-5-17/h1-5,8-16H,(H,24,25)/p-1