Reproterol hydrochloride (USAN)

Properties Image MNX_ID MNXM160820 reference keggD:D05718 formula C18H24ClN5O5 global charge 0 mol weight 425.873 InChIKey XSFWDHONRBZVEJ-UHFFFAOYSA-N InChI InChI=1S/C18H23N5O5.ClH/c1-21-16-15(17(27)22(2)18(21)28)23(10-20-16)5-3-4-19-9-14(26)11-6-12(24)8-13(25)7-11;/h6-8,10,14,19,24-26H,3-5,9H2,1-2H3;1H SMILES CN1C(=O)C2=C(N=CN2CCCNCC(O)C2=CC(O)=CC(O)=C2)N(C)C1=O.Cl MNX internals InChI (mnx) InChI=1/C18H23N5O5.ClH/c1-21-16-15(17(27)22(2)18(21)28)23(10-20-16)5-3-4-19-9-14(26)11-6-12(24)8-13(25)7-11;/h6-8,10,14,19,24-26H,3-5,9H2,1-2H3;1H/t14?; SMILES (mnx) [CH3:1][N:21]1[C:16]2=[C:15]([C:17](=[O:27])[N:22]([CH3:2])[C:18]1=[O:28])[N:23]([CH2:5][CH2:3][CH2:4][NH:19][CH2:9][CH:14]([C:11]1=[CH:6][C:12]([OH:24])=[CH:8][C:13]([OH:25])=[CH:7]1)[OH:26])[CH:10]=[N:20]2.[ClH:29]

Parent-child relations graph

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