4-bromanyl-N-(3-ethynylphenyl)-1H-pyrrole-2-carboxamide

Systemtic Name: 4-bromanyl-N-(3-ethynylphenyl)-1H-pyrrole-2-carboxamide Openeye Name: 4-bromo-N-(3-ethynylphenyl)-1H-pyrrole-2-carboxamide CAS Name: 4-bromo-N-(3-ethynylphenyl)-1H-pyrrole-2-carboxamide IUPAC Name: 4-bromo-N-(3-ethynylphenyl)-1H-pyrrole-2-carboxamide Traditional Name: 4-bromo-N-(3-ethynylphenyl)-1H-pyrrole-2-carboxamide Formula: C13H9BrN2O MolecularWeight: 289.12736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)C2=CC(=CN2)Br

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C13H9BrN2O/c1-2-9-4-3-5-11(6-9)16-13(17)12-7-10(14)8-15-12/h1,3-8,15H,(H,16,17)