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(-c2cc(-c3ccccc3)cc(N(C)CCc3ccccc3)n2)ccc1O
InChI=1S/C27H26N2O/c1-20-17-23(13-14-26(20)30)25-18-24(22-11-7-4-8-12-22)19-27(28-25)29(2)16-15-21-9-5-3-6-10-21/h3-14,17-19,30H,15-16H2,1-2H3
CNZVGKSWGGJIMU-UHFFFAOYSA-N
394.52