compound 0215746

Properties Image MNX_ID MNXM1191396 reference envipathM:...fb64c6f3d4f0 formula C16H23ClN2O3 global charge 0 mol weight 326.824 InChIKey DJUFAGKOZIHFFM-UHFFFAOYSA-N InChI InChI=1S/C16H23ClN2O3/c1-10-8-12(17)9-11(2)13(10)14(20)15(21)16(18)4-6-19(22-3)7-5-16/h8-9,14,20H,4-7,18H2,1-3H3 SMILES CON1CCC(N)(C(=O)C(O)C2=C(C)C=C(Cl)C=C2C)CC1 MNX internals InChI (mnx) InChI=1/C16H23ClN2O3/c1-10-8-12(17)9-11(2)13(10)14(20)15(21)16(18)4-6-19(22-3)7-5-16/h8-9,14,20H,4-7,18H2,1-3H3/t14? SMILES (mnx) [CH3:1][C:10]1=[CH:8][C:12]([Cl:17])=[CH:9][C:11]([CH3:2])=[C:13]1[CH:14]([C:15]([C:16]1([NH2:18])[CH2:4][CH2:6][N:19]([O:22][CH3:3])[CH2:7][CH2:5]1)=[O:21])[OH:20]

Parent-child relations graph

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