4-amino-6-(3,4-dimethoxyphenyl)-2,2-dipropoxy-3-azoniabicyclo[3.1.0]hex-3-ene-1,5-dicarbonitrile

Molecular Formula: C21H27N4O4+


InChI: InChI=1/C21H26N4O4/c1-5-9-28-21(29-10-6-2)20(13-23)17(19(20,12-22)18(24)25-21)14-7-8-15(26-3)16(11-14)27-4/h7-8,11,17H,5-6,9-10H2,1-4H3,(H2,24,25)/p+1/fC21H27N4O4/h25H,24H2/q+1

InChIKey: InChIKey=QCGOBJTWXBRGRX-WTDMZJJDCB
SMILES: CCCOC1(C2(C(C2(C(=[NH+]1)N)C#N)C3=CC(=C(C=C3)OC)OC)C#N)OCCC

Names:
    4-amino-6-(3,4-dimethoxyphenyl)-2,2-dipropoxy-3-azoniabicyclo[3.1.0]hex-3-ene-1,5-dicarbonitrile

Registries:
    PubChem CID 3566966
    PubChem ID 4830115