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
Cc1ccc2c(c1)oc(=O)n2CCOc1ccnc2cc(-c3cnn(C)c3)ccc12
InChI=1S/C23H20N4O3/c1-15-3-6-20-22(11-15)30-23(28)27(20)9-10-29-21-7-8-24-19-12-16(4-5-18(19)21)17-13-25-26(2)14-17/h3-8,11-14H,9-10H2,1-2H3
LJEFFXUGINDTNG-UHFFFAOYSA-N
400.44