N-Methylnaltrindole

Molecular Formula: C27H28N2O3


InChI: InChI=1/C27H28N2O3/c1-28-19-5-3-2-4-17(19)18-13-27(31)21-12-16-8-9-20(30)24-22(16)26(27,25(32-24)23(18)28)10-11-29(21)14-15-6-7-15/h2-5,8-9,15,21,25,30-31H,6-7,10-14H2,1H3/t21-,25-,26-,27+/m0/s1

InChIKey: InChIKey=CRTCCMARDBQOKA-OAHAWELDBK
SMILES: CN1C2=CC=CC=C2C3=C1C4C56CCN(C(C5(C3)O)CC7=C6C(=C(C=C7)O)O4)CC8CC8

Names:
    N-Methylnaltrindole
    N-METHYL-NALTRINDOLE, C-11
    111555-57-8
    4,8-Methanobenzofuro(2,3-a)pyrido(4,3-b)carbazole-1,8a(9H)-diol, 7-(cyclopropylmethyl)-5,6,7,8,14,14b-hexahydro-14-methyl-, (8R-(4bS*,8alpha,8abeta,14bbeta))-

Registries:
    PubChem CID 5362396
    PubChem ID 196798