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
COc1cc(CCN(C)Cc2ccc(OC)c(OC)c2)ccc1NC(=O)c1cccc2c(O)c3cccc(F)c3nc12
InChI=1S/C33H32FN3O5/c1-37(19-21-12-14-27(40-2)29(18-21)42-4)16-15-20-11-13-26(28(17-20)41-3)35-33(39)24-9-5-7-22-30(24)36-31-23(32(22)38)8-6-10-25(31)34/h5-14,17-18H,15-16,19H2,1-4H3,(H,35,39)(H,36,38)
JXZRRBRNULIVBJ-UHFFFAOYSA-N
569.63