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
[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2nccc(C)n2)c1OC
InChI=1S/C22H23N7O3/c1-12-9-10-24-20(25-12)14-5-4-6-15(19(14)32-3)26-16-11-17(27-21(30)13-7-8-13)28-29-18(16)22(31)23-2/h4-6,9-11,13H,7-8H2,1-3H3,(H,23,31)(H2,26,27,28,30)/i2D3
OMTFNACBHQZNBQ-BMSJAHLVSA-N
436.49