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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
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CCN(CC)CCCC(C)Nc1cc(/C=C/c2c[nH]c3ccccc23)nc2ccccc12
InChI=1S/C28H34N4/c1-4-32(5-2)18-10-11-21(3)30-28-19-23(31-27-15-9-7-13-25(27)28)17-16-22-20-29-26-14-8-6-12-24(22)26/h6-9,12-17,19-21,29H,4-5,10-11,18H2,1-3H3,(H,30,31)/b17-16+
BYBGNSMWWPYKOB-WUKNDPDISA-N
426.61
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