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
O=C(N[C@H]1CC[C@H](CCN2CCc3ccccc3C2)CC1)c1ccccc1
InChI=1S/C24H30N2O/c27-24(21-7-2-1-3-8-21)25-23-12-10-19(11-13-23)14-16-26-17-15-20-6-4-5-9-22(20)18-26/h1-9,19,23H,10-18H2,(H,25,27)/t19-,23-
VLIWRKCRUPBCQS-UILWBTOOSA-N
362.52