(3-propyl-1H-indol-5-yl)methanesulfonic acid

Properties Image MNX_ID MNXM171888 reference chebi:125605 formula C12H15NO3S global charge 0 mol weight 253.323 InChIKey WYFJNQLEVJHNQH-UHFFFAOYSA-N InChI InChI=1S/C12H15NO3S/c1-2-3-10-7-13-12-5-4-9(6-11(10)12)8-17(14,15)16/h4-7,13H,2-3,8H2,1H3,(H,14,15,16) SMILES CCCC1=CNC2=C1C=C(CS(=O)(=O)O)C=C2 MNX internals InChI (mnx) InChI=1/C12H15NO3S/c1-2-3-10-7-13-12-5-4-9(6-11(10)12)8-17(14,15)16/h4-7,13H,2-3,8H2,1H3,(H,14,15,16) SMILES (mnx) [CH3:1][CH2:2][CH2:3][C:10]1=[CH:7][NH:13][C:12]2=[C:11]1[CH:6]=[C:9]([CH2:8][S:17]([OH:14])(=[O:15])=[O:16])[CH:4]=[CH:5]2

Parent-child relations graph

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