4-chloranyl-N-[4-(cyanomethyl)phenyl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-chloranyl-N-[4-(cyanomethyl)phenyl]-1H-pyrrole-2-carboxamide Openeye Name: 4-chloro-N-[4-(cyanomethyl)phenyl]-1H-pyrrole-2-carboxamide CAS Name: 4-chloro-N-[4-(cyanomethyl)phenyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-chloro-N-[4-(cyanomethyl)phenyl]-1H-pyrrole-2-carboxamide Traditional Name: 4-chloro-N-[4-(cyanomethyl)phenyl]-1H-pyrrole-2-carboxamide Formula: C13H10ClN3O MolecularWeight: 259.691

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)NC(=O)C2=CC(=CN2)Cl

Isomeric SMILES

C1=CC(=CC=C1CC#N)NC(=O)C2=CC(=CN2)Cl

InChI

InChI=1S/C13H10ClN3O/c14-10-7-12(16-8-10)13(18)17-11-3-1-9(2-4-11)5-6-15/h1-4,7-8,16H,5H2,(H,17,18)