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
CNC(=O)c1nnc(NC(=O)C2CC2)c2[nH]c(-c3ccc(N)cc3OC)cc12
InChI=1S/C19H20N6O3/c1-21-19(27)16-12-8-13(11-6-5-10(20)7-14(11)28-2)22-15(12)17(25-24-16)23-18(26)9-3-4-9/h5-9,22H,3-4,20H2,1-2H3,(H,21,27)(H,23,25,26)
FGFGLAJKHODMGZ-UHFFFAOYSA-N
380.41