5-bromanyl-N-[4-(cyanomethyl)phenyl]-1H-indole-3-carboxamide

Systemtic Name: 5-bromanyl-N-[4-(cyanomethyl)phenyl]-1H-indole-3-carboxamide Openeye Name: 5-bromo-N-[4-(cyanomethyl)phenyl]-1H-indole-3-carboxamide CAS Name: 5-bromo-N-[4-(cyanomethyl)phenyl]-1H-indole-3-carboxamide IUPAC Name: 5-bromo-N-[4-(cyanomethyl)phenyl]-1H-indole-3-carboxamide Traditional Name: 5-bromo-N-[4-(cyanomethyl)phenyl]-1H-indole-3-carboxamide Formula: C17H12BrN3O MolecularWeight: 354.20068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)NC(=O)C2=CNC3=C2C=C(C=C3)Br

Isomeric SMILES

C1=CC(=CC=C1CC#N)NC(=O)C2=CNC3=C2C=C(C=C3)Br

InChI

InChI=1S/C17H12BrN3O/c18-12-3-6-16-14(9-12)15(10-20-16)17(22)21-13-4-1-11(2-5-13)7-8-19/h1-6,9-10,20H,7H2,(H,21,22)