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
CC1(C)CCC(NCCCCN(C[C@H]2Cc3ccccc3CN2)[C@H]2CCCc3cccnc32)CC1
InChI=1S/C31H46N4/c1-31(2)16-14-27(15-17-31)32-18-5-6-20-35(29-13-7-11-24-12-8-19-33-30(24)29)23-28-21-25-9-3-4-10-26(25)22-34-28/h3-4,8-10,12,19,27-29,32,34H,5-7,11,13-18,20-23H2,1-2H3/t28-,29+/m1/s1
ONNXLKVJJQMNHD-WDYNHAJCSA-N
474.74