(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-[3-(4-fluoranylphenoxy)propyl]azanium

Systemtic Name: (6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-[3-(4-fluoranylphenoxy)propyl]azanium Openeye Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-[3-(4-fluorophenoxy)propyl]ammonium CAS Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-[3-(4-fluorophenoxy)propyl]ammonium IUPAC Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-[3-(4-fluorophenoxy)propyl]azanium Traditional Name: ethyl-[3-(4-fluorophenoxy)propyl]-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl]ammonium Formula: C22H27FN3O4+ MolecularWeight: 416.465883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCCOC1=CC=C(C=C1)F)CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

Isomeric SMILES

CC[NH+](CCCOC1=CC=C(C=C1)F)CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

InChI

InChI=1S/C22H26FN3O4/c1-4-26(10-5-11-30-16-8-6-15(23)7-9-16)14-21-24-18-13-20(29-3)19(28-2)12-17(18)22(27)25-21/h6-9,12-13H,4-5,10-11,14H2,1-3H3,(H,24,25,27)/p+1