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
COc1ccc(CCNCC(O)COc2ccc(-c3nc(-c4cccs4)c[nH]3)cc2C)cc1OC
InChI=1S/C27H31N3O4S/c1-18-13-20(27-29-16-22(30-27)26-5-4-12-35-26)7-9-23(18)34-17-21(31)15-28-11-10-19-6-8-24(32-2)25(14-19)33-3/h4-9,12-14,16,21,28,31H,10-11,15,17H2,1-3H3,(H,29,30)
FVFVOIAVOYZLTQ-UHFFFAOYSA-N
493.63