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=C1Nc2ccccc2C1C[C@H]1N=C(c2ccccc2)c2cc(Cl)ccc2NC1=O
InChI=1S/C24H18ClN3O2/c25-15-10-11-20-18(12-15)22(14-6-2-1-3-7-14)26-21(24(30)28-20)13-17-16-8-4-5-9-19(16)27-23(17)29/h1-12,17,21H,13H2,(H,27,29)(H,28,30)/t17?,21-/m1/s1
CTQOKAYZEWKBNS-FBLFFUNLSA-N
415.88