methyl (2S)-3-(1H-indol-3-yl)-2-isocyanopropanoate

Properties Image MNX_ID MNXM1100762 reference seedM:cpd34353 formula C13H13N2O2 global charge 1 mol weight 229.259 InChIKey BLNJASSNJNEKHB-LBPRGKRZSA-N InChI InChI=1S/C13H13N2O2/c1-14-12(13(16)17-2)7-9-8-15-11-6-4-3-5-10(9)11/h1,3-6,8,12,15H,7H2,2H3/q+1/t12-/m0/s1 SMILES C#[N+][C@@H](CC1=CNC2=CC=CC=C12)C(=O)OC MNX internals InChI (mnx) InChI=1/C13H13N2O2/c1-14-12(13(16)17-2)7-9-8-15-11-6-4-3-5-10(9)11/h1,3-6,8,12,15H,7H2,2H3/q+1/t12-/m0/s1 SMILES (mnx) [CH:1]#[N+:14][C@@H:12]([CH2:7][C:9]1=[CH:8][NH:15][C:11]2=[CH:6][CH:4]=[CH:3][CH:5]=[C:10]12)[C:13](=[O:16])[O:17][CH3:2]

Parent-child relations graph

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