Title is now set by the underlying SMILES parser and is more correct when the input is CXSMILES.

johnmay · johnmay · commit da62dae6a46b · 2021-01-10T19:19:15.000Z
diff --git a/storage/smiles/src/main/java/org/openscience/cdk/io/iterator/IteratingSMILESReader.java b/storage/smiles/src/main/java/org/openscience/cdk/io/iterator/IteratingSMILESReader.java
@@ -133,8 +133,6 @@ public boolean hasNext() {
                 final String suffix = suffix(line);
 
                 nextMolecule = readSmiles(line);
-                nextMolecule.setTitle(suffix);
-
             } catch (Exception exception) {
                 logger.error("Unexpected problem: ", exception.getMessage());
                 logger.debug(exception);
