Nomifensine maleate (USAN)

Properties Image MNX_ID MNXM158759 reference keggD:D05200 formula C20H22N2O4 global charge 0 mol weight 354.406 InChIKey GEOCVSMCLVIOEV-BTJKTKAUSA-N InChI InChI=1S/C16H18N2.C4H4O4/c1-18-10-14(12-6-3-2-4-7-12)13-8-5-9-16(17)15(13)11-18;5-3(6)1-2-4(7)8/h2-9,14H,10-11,17H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1- SMILES CN1CC2=C(N)C=CC=C2C(C2=CC=CC=C2)C1.O=C(O)/C=C\C(=O)O MNX internals InChI (mnx) InChI=1/C16H18N2.C4H4O4/c1-18-10-14(12-6-3-2-4-7-12)13-8-5-9-16(17)15(13)11-18;5-3(6)1-2-4(7)8/h2-9,14H,10-11,17H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t14?; SMILES (mnx) [CH3:1][N:18]1[CH2:10][CH:14]([C:12]2=[CH:6][CH:3]=[CH:2][CH:4]=[CH:7]2)[C:13]2=[C:15]([CH2:11]1)[C:16]([NH2:17])=[CH:9][CH:5]=[CH:8]2.[CH:19](=[CH:20]\[C:22](=[O:25])[OH:26])\[C:21](=[O:23])[OH:24]

Parent-child relations graph

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