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
COc1ccc2c3ccnc(C)c3n(CCNC(=O)/C=C/c3ccc(C)cc3)c2c1
InChI=1S/C25H25N3O2/c1-17-4-6-19(7-5-17)8-11-24(29)27-14-15-28-23-16-20(30-3)9-10-21(23)22-12-13-26-18(2)25(22)28/h4-13,16H,14-15H2,1-3H3,(H,27,29)/b11-8+
CLGCKVRTEZMYGU-DHZHZOJOSA-N
399.49