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
COc1cc(C)c2[nH]ccc2c1CN1CC[C@H](OC)C[C@H]1c1ccc(C(=O)O)cc1
InChI=1S/C24H28N2O4/c1-15-12-22(30-3)20(19-8-10-25-23(15)19)14-26-11-9-18(29-2)13-21(26)16-4-6-17(7-5-16)24(27)28/h4-8,10,12,18,21,25H,9,11,13-14H2,1-3H3,(H,27,28)/t18-,21-/m0/s1
MNWOIQKVANULGE-RXVVDRJESA-N
408.5