3-bromanyl-4-(2-butyl-1H-indol-3-yl)pyrrole-2,5-dione

Systemtic Name: 3-bromanyl-4-(2-butyl-1H-indol-3-yl)pyrrole-2,5-dione Openeye Name: 3-bromo-4-(2-butyl-1H-indol-3-yl)pyrrole-2,5-dione CAS Name: 3-bromo-4-(2-butyl-1H-indol-3-yl)pyrrole-2,5-dione IUPAC Name: 3-bromo-4-(2-butyl-1H-indol-3-yl)pyrrole-2,5-dione Traditional Name: 3-bromo-4-(2-butyl-1H-indol-3-yl)-3-pyrroline-2,5-quinone Formula: C16H15BrN2O2 MolecularWeight: 347.2065

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2N1)C3=C(C(=O)NC3=O)Br

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2N1)C3=C(C(=O)NC3=O)Br

InChI

InChI=1S/C16H15BrN2O2/c1-2-3-7-11-12(9-6-4-5-8-10(9)18-11)13-14(17)16(21)19-15(13)20/h4-6,8,18H,2-3,7H2,1H3,(H,19,20,21)