Cycliramine maleate (USAN)

Properties Image MNX_ID MNXM48035 reference keggD:D03620 formula C22H23ClN2O4 global charge 0 mol weight 414.889 InChIKey KJSKCUMUVXPETM-BTJKTKAUSA-N InChI InChI=1S/C18H19ClN2.C4H4O4/c1-21-12-9-15(10-13-21)18(17-4-2-3-11-20-17)14-5-7-16(19)8-6-14;5-3(6)1-2-4(7)8/h2-8,11H,9-10,12-13H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1- SMILES CN1CCC(=C(C2=CC=C(Cl)C=C2)C2=NC=CC=C2)CC1.O=C(O)/C=C\C(=O)O MNX internals InChI (mnx) InChI=1/C18H19ClN2.C4H4O4/c1-21-12-9-15(10-13-21)18(17-4-2-3-11-20-17)14-5-7-16(19)8-6-14;5-3(6)1-2-4(7)8/h2-8,11H,9-10,12-13H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1- SMILES (mnx) [CH3:1][N:21]1[CH2:12][CH2:9][C:15](=[C:18]([C:14]2=[CH:6][CH:8]=[C:16]([Cl:19])[CH:7]=[CH:5]2)[C:17]2=[CH:4][CH:2]=[CH:3][CH:11]=[N:20]2)[CH2:10][CH2:13]1.[CH:22](=[CH:23]\[C:25](=[O:28])[OH:29])\[C:24](=[O:26])[OH:27]

Parent-child relations graph

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