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
Cc1c(CC[C@@H](O)C[C@@H](O)CC(=O)[O-])c(-c2ccc(F)cc2)cn1C(C)C.[Na+]
InChI=1S/C21H28FNO4.Na/c1-13(2)23-12-20(15-4-6-16(22)7-5-15)19(14(23)3)9-8-17(24)10-18(25)11-21(26)27;/h4-7,12-13,17-18,24-25H,8-11H2,1-3H3,(H,26,27);/q;+1/p-1/t17-,18-;/m1./s1
MUOXIDSUZSZCNE-JAXOOIEVSA-M
399.44