4-(3-phenylprop-2-ynoylamino)benzoic acid

Systemtic Name: 4-(3-phenylprop-2-ynoylamino)benzoic acid Openeye Name: 4-(3-phenylprop-2-ynoylamino)benzoic acid CAS Name: 4-[(1-oxo-3-phenylprop-2-ynyl)amino]benzoic acid IUPAC Name: 4-(3-phenylprop-2-ynoylamino)benzoic acid Traditional Name: 4-[(3-phenylpropioloyl)amino]benzoic acid Formula: C16H11NO3 MolecularWeight: 265.26344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C#CC(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H11NO3/c18-15(11-6-12-4-2-1-3-5-12)17-14-9-7-13(8-10-14)16(19)20/h1-5,7-10H,(H,17,18)(H,19,20)