Roxatidine acetate hydrochloride

Properties Image MNX_ID MNXM160894 reference chebi:32107 formula C19H29ClN2O4 global charge 0 mol weight 384.904 InChIKey FEWCTJHCXOHWNL-UHFFFAOYSA-N InChI InChI=1S/C19H28N2O4.ClH/c1-16(22)25-15-19(23)20-9-6-12-24-18-8-5-7-17(13-18)14-21-10-3-2-4-11-21;/h5,7-8,13H,2-4,6,9-12,14-15H2,1H3,(H,20,23);1H SMILES CC(=O)OCC(=O)NCCCOC1=CC=CC(CN2CCCCC2)=C1.Cl MNX internals InChI (mnx) InChI=1/C19H28N2O4.ClH/c1-16(22)25-15-19(23)20-9-6-12-24-18-8-5-7-17(13-18)14-21-10-3-2-4-11-21;/h5,7-8,13H,2-4,6,9-12,14-15H2,1H3,(H,20,23);1H SMILES (mnx) [CH3:1][C:16](=[O:22])[O:25][CH2:15][C:19](=[N:20][CH2:9][CH2:6][CH2:12][O:24][C:18]1=[CH:8][CH:5]=[CH:7][C:17]([CH2:14][N:21]2[CH2:10][CH2:3][CH2:2][CH2:4][CH2:11]2)=[CH:13]1)[OH:23].[ClH:26]

Parent-child relations graph

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