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(C(=O)Nc2ccc(N3CCCCC3)cc2)c1OC
InChI=1S/C29H33N7O4/c1-30-29(39)25-23(17-24(34-35-25)33-27(37)18-9-10-18)32-22-8-6-7-21(26(22)40-2)28(38)31-19-11-13-20(14-12-19)36-15-4-3-5-16-36/h6-8,11-14,17-18H,3-5,9-10,15-16H2,1-2H3,(H,30,39)(H,31,38)(H2,32,33,34,37)/i1D3
OGXVGSHMFIOASG-FIBGUPNXSA-N
546.65