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
C=CC(=O)N1CCN(CCCCCn2nc(-c3cc(F)cc(OC)c3)c3c(N)ncnc32)CC1
InChI=1S/C24H30FN7O2/c1-3-20(33)31-11-9-30(10-12-31)7-5-4-6-8-32-24-21(23(26)27-16-28-24)22(29-32)17-13-18(25)15-19(14-17)34-2/h3,13-16H,1,4-12H2,2H3,(H2,26,27,28)
PSJRJLXQWSBSMQ-UHFFFAOYSA-N
467.55