benzyl-[3-[[2-[8-[(3-fluorophenyl)methylidene]-9-oxo-7-oxa-10-azabicyclo[4.4.0]deca-1,3,5-trien-10-yl]acetyl]amino]propyl]-propan-2-yl-azanium

Molecular Formula: C30H33FN3O3+


InChI: InChI=1/C30H32FN3O3/c1-22(2)33(20-23-10-4-3-5-11-23)17-9-16-32-29(35)21-34-26-14-6-7-15-27(26)37-28(30(34)36)19-24-12-8-13-25(31)18-24/h3-8,10-15,18-19,22H,9,16-17,20-21H2,1-2H3,(H,32,35)/p+1/fC30H33FN3O3/h32-33H/q+1

InChIKey: InChIKey=JNTKSHBCQXACTI-JXHWDJEBCK
SMILES: CC(C)[NH+](CCCNC(=O)CN1C2=CC=CC=C2OC(=CC3=CC(=CC=C3)F)C1=O)CC4=CC=CC=C4

Names:
    benzyl-[3-[[2-[8-[(3-fluorophenyl)methylidene]-9-oxo-7-oxa-10-azabicyclo[4.4.0]deca-1,3,5-trien-10-yl]acetyl]amino]propyl]-propan-2-yl-azanium

Registries:
    PubChem CID 4090723
    PubChem ID 6009706