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
c1cc(N2CCN(c3ccc(C4=NCCN4)cc3)CC2)ccc1C1=NCCN1
InChI=1S/C22H26N6/c1-5-19(6-2-17(1)21-23-9-10-24-21)27-13-15-28(16-14-27)20-7-3-18(4-8-20)22-25-11-12-26-22/h1-8H,9-16H2,(H,23,24)(H,25,26)
SBVUTMQIJNCYIG-UHFFFAOYSA-N
374.49