Task: Please create a SMILES based on the text description below.
Description: The molecule is an isocyanate comprising a cyclohexane core with a single isocyanato substituent. It has a role as an allergen.
Result: O=C=NC1CCCCC1
Task: Please {#give me|create|generate!} a {#molecule |!}{SMILES__description} based on the {#text |!}description{# below|!}.
Description: {description#}
Result: {SMILES#}
O=C=NC1CCCCC1
isocyanatocyclohexane
The molecule is an isocyanate comprising a cyclohexane core with a single isocyanato substituent. It has a role as an allergen.