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

Systemtic Name: 4-chloranyl-2-(3-phenylprop-2-ynoylamino)benzoic acid Openeye Name: 4-chloro-2-(3-phenylprop-2-ynoylamino)benzoic acid CAS Name: 4-chloro-2-[(1-oxo-3-phenylprop-2-ynyl)amino]benzoic acid IUPAC Name: 4-chloro-2-(3-phenylprop-2-ynoylamino)benzoic acid Traditional Name: 4-chloro-2-[(3-phenylpropioloyl)amino]benzoic acid Formula: C16H10ClNO3 MolecularWeight: 299.7085

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10ClNO3/c17-12-7-8-13(16(20)21)14(10-12)18-15(19)9-6-11-4-2-1-3-5-11/h1-5,7-8,10H,(H,18,19)(H,20,21)