(S)-esmolol

Properties Image MNX_ID MNXM31825 reference chebi:60075 formula C16H25NO4 global charge 0 mol weight 295.379 InChIKey AQNDDEOPVVGCPG-AWEZNQCLSA-N InChI InChI=1S/C16H25NO4/c1-12(2)17-10-14(18)11-21-15-7-4-13(5-8-15)6-9-16(19)20-3/h4-5,7-8,12,14,17-18H,6,9-11H2,1-3H3/t14-/m0/s1 SMILES COC(=O)CCC1=CC=C(OC[C@@H](O)CNC(C)C)C=C1 MNX internals InChI (mnx) InChI=1/C16H25NO4/c1-12(2)17-10-14(18)11-21-15-7-4-13(5-8-15)6-9-16(19)20-3/h4-5,7-8,12,14,17-18H,6,9-11H2,1-3H3/t14-/m0/s1 SMILES (mnx) [CH3:1][CH:12]([CH3:2])[NH:17][CH2:10][C@@H:14]([CH2:11][O:21][C:15]1=[CH:8][CH:5]=[C:13]([CH2:6][CH2:9][C:16](=[O:19])[O:20][CH3:3])[CH:4]=[CH:7]1)[OH:18]

Parent-child relations graph

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