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
Cn1c(=O)[nH]/c(=N\c2ccc(Oc3cccc(C#N)n3)cc2)n(C[C@H]2CC[C@H](C)CC2)c1=O
InChI=1S/C24H26N6O3/c1-16-6-8-17(9-7-16)15-30-22(28-23(31)29(2)24(30)32)27-18-10-12-20(13-11-18)33-21-5-3-4-19(14-25)26-21/h3-5,10-13,16-17H,6-9,15H2,1-2H3,(H,27,28,31)/t16-,17-
ICHNQQKORBCVCY-QAQDUYKDSA-N
446.51