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
COc1ncccc1COC(=O)N1CCN(Cc2cncn2Cc2ccc(C#N)cc2)CC1
InChI=1S/C24H26N6O3/c1-32-23-21(3-2-8-27-23)17-33-24(31)29-11-9-28(10-12-29)16-22-14-26-18-30(22)15-20-6-4-19(13-25)5-7-20/h2-8,14,18H,9-12,15-17H2,1H3
NMPOEHMYTSFAOT-UHFFFAOYSA-N
446.51