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
C[C@@H](NC(=O)/N=C(\N)NCCCc1ncn[nH]1)c1ccccc1.Cl.Cl
InChI=1S/C15H21N7O.2ClH/c1-11(12-6-3-2-4-7-12)20-15(23)21-14(16)17-9-5-8-13-18-10-19-22-13;;/h2-4,6-7,10-11H,5,8-9H2,1H3,(H,18,19,22)(H4,16,17,20,21,23);2*1H/t11-;;/m1../s1
XRYVFZXIDAULKH-NVJADKKVSA-N
388.3