Alonimid (USAN/INN)

Properties Image MNX_ID MNXM40895 reference keggD:D02828 formula C14H13NO3 global charge 0 mol weight 243.262 InChIKey WZAIVXXKOAWTGQ-UHFFFAOYSA-N InChI InChI=1S/C14H13NO3/c16-11-5-7-14(8-6-12(17)15-13(14)18)10-4-2-1-3-9(10)11/h1-4H,5-8H2,(H,15,17,18) SMILES O=C1CCC2(CCC(=O)C3=C2C=CC=C3)C(=O)N1 MNX internals InChI (mnx) InChI=1/C14H13NO3/c16-11-5-7-14(8-6-12(17)15-13(14)18)10-4-2-1-3-9(10)11/h1-4H,5-8H2,(H,15,17,18)/t14? SMILES (mnx) [CH:1]1=[CH:2][CH:4]=[C:10]2[C:9](=[CH:3]1)[C:11](=[O:16])[CH2:5][CH2:7][C:14]21[CH2:8][CH2:6][C:12]([OH:17])=[N:15][C:13]1=[O:18]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0