(1R,3S)-3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester

Properties Image MNX_ID MNXM169745 reference chebi:125381 formula C16H20INO2 global charge 0 mol weight 385.245 InChIKey SIIICDNNMDMWCI-LMRVLLHPSA-N InChI InChI=1S/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13-,14?,15?/m1/s1 SMILES COC(=O)C1C2CC[C@H](C[C@@H]1C1=CC=C(I)C=C1)N2C MNX internals InChI (mnx) InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13-,14?,15?/m1/s1 SMILES (mnx) [CH3:1][N:18]1[C@@H:12]2[CH2:7][CH2:8][CH:14]1[CH:15]([C:16](=[O:19])[O:20][CH3:2])[C@@H:13]([C:10]1=[CH:4][CH:6]=[C:11]([I:17])[CH:5]=[CH:3]1)[CH2:9]2

Parent-child relations graph

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