Identifier Cleaner
Convert between SMILES, InChI, InChIKey, and compound names. Supports PubChem name resolution as a fallback when the input is a common drug name.
Example: aspirin
→ CC(=O)Oc1ccccc1C(=O)O
Cc1cc(OCc2sc(-c3ccc(C(F)(F)F)cc3)nc2C)ccc1CCC(=O)O
InChI=1S/C22H20F3NO3S/c1-13-11-18(9-5-15(13)6-10-20(27)28)29-12-19-14(2)26-21(30-19)16-3-7-17(8-4-16)22(23,24)25/h3-5,7-9,11H,6,10,12H2,1-2H3,(H,27,28)
RSLROHSQFVXOLQ-UHFFFAOYSA-N
435.47