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
COc1cc(NC(=O)c2c[nH]c3ccc(C(C)(C)C)cc3c2=O)cc(OC)c1OC
InChI=1S/C23H26N2O5/c1-23(2,3)13-7-8-17-15(9-13)20(26)16(12-24-17)22(27)25-14-10-18(28-4)21(30-6)19(11-14)29-5/h7-12H,1-6H3,(H,24,26)(H,25,27)
FXWZNRSZOBNRRY-UHFFFAOYSA-N
410.47