Motofen

Molecular Formula: C₆₂H₇₉ClN₄O₁₃S

InChI: InChI=1/C28H28N2O2.2C17H23NO3.ClH.H2O4S.H2O/c29-22-28(24-12-6-2-7-13-24,25-14-8-3-9-15-25)18-21-30-19-16-27(17-20-30,26(31)32)23-10-4-1-5-11-23;2*1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12;;1-5(2,3)4;/h1-15H,16-21H2,(H,31,32);2*2-6,13-16,19H,7-11H2,1H3;1H;(H2,1,2,3,4);1H2/t;2*13-,14+,15?,16u;;;/f/h31H;;;;1-2H;

InChIKey: InChIKey=LWAQAVXMKMJVAM-BWQOTUENDA
SMILES: CN1C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3.CN1C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3.C1CN(CCC1(C2=CC=CC=C2)C(=O)O)CCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4.O.OS(=O)(=O)O.Cl

Names:
    Difenoxin-atropine
    D02128
    Motofen (TN)
    Motofen
    1-(3-cyano-3,3-diphenyl-propyl)-4-phenyl-piperidine-4-carboxylic acid; [(1R,5S)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl] 3-hydroxy-2-phenyl-propanoate; sulfuric acid; hydrate; hydrochloride

Registries:
    PubChem CID 656704
    PubChem ID 7849189