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
Cc1c2c(C(=O)NCCN(C)C)nccc2c(C)c2c1c1cc(OC(=O)CCCC(=O)O)ccc1n2C
InChI=1S/C28H32N4O5/c1-16-19-11-12-29-26(28(36)30-13-14-31(3)4)24(19)17(2)25-20-15-18(9-10-21(20)32(5)27(16)25)37-23(35)8-6-7-22(33)34/h9-12,15H,6-8,13-14H2,1-5H3,(H,30,36)(H,33,34)
SKUONFDZCWFMMQ-UHFFFAOYSA-N
504.59