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
CCCOc1ccc(/C=C/C(=O)NCCCNc2c3c(nc4ccccc24)CCCC3)cc1OC
InChI=1S/C29H35N3O3/c1-3-19-35-26-15-13-21(20-27(26)34-2)14-16-28(33)30-17-8-18-31-29-22-9-4-6-11-24(22)32-25-12-7-5-10-23(25)29/h4,6,9,11,13-16,20H,3,5,7-8,10,12,17-19H2,1-2H3,(H,30,33)(H,31,32)/b16-14+
MPXQSLWIVILKJD-JQIJEIRASA-N
473.62