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
CCN(CCCCCCn1nc(-c2cc(NC(C)=O)ccc2O)ccc1=O)Cc1ccccc1OC
InChI=1S/C28H36N4O4/c1-4-31(20-22-11-7-8-12-27(22)36-3)17-9-5-6-10-18-32-28(35)16-14-25(30-32)24-19-23(29-21(2)33)13-15-26(24)34/h7-8,11-16,19,34H,4-6,9-10,17-18,20H2,1-3H3,(H,29,33)
ACIBBJLXURJPAB-UHFFFAOYSA-N
492.62