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
O=C(O)c1csc([C@H]2CC[C@@H]3[C@@H](COc4cc(Cl)c(Cl)cc4Cl)[C@H](O)C[C@@H]3O2)n1
InChI=1S/C19H18Cl3NO5S/c20-10-3-12(22)17(4-11(10)21)27-6-9-8-1-2-15(28-16(8)5-14(9)24)18-23-13(7-29-18)19(25)26/h3-4,7-9,14-16,24H,1-2,5-6H2,(H,25,26)/t8-,9-,14-,15-,16+/m1/s1
QXLKYFRBDUBDRV-FDYWUGNBSA-N
478.78