(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-[(1R)-1-(4-fluorophenyl)-2-methyl-propyl]azanium

Systemtic Name: (6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-[(1R)-1-(4-fluorophenyl)-2-methyl-propyl]azanium Openeye Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-[(1R)-1-(4-fluorophenyl)-2-methyl-propyl]ammonium CAS Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-[(1R)-1-(4-fluorophenyl)-2-methylpropyl]ammonium IUPAC Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-[(1R)-1-(4-fluorophenyl)-2-methylpropyl]azanium Traditional Name: [(1R)-1-(4-fluorophenyl)-2-methyl-propyl]-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl]ammonium Formula: C21H25FN3O3+ MolecularWeight: 386.439903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)F)[NH2+]CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

Isomeric SMILES

CC(C)[C@H](C1=CC=C(C=C1)F)[NH2+]CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

InChI

InChI=1S/C21H24FN3O3/c1-12(2)20(13-5-7-14(22)8-6-13)23-11-19-24-16-10-18(28-4)17(27-3)9-15(16)21(26)25-19/h5-10,12,20,23H,11H2,1-4H3,(H,24,25,26)/p+1/t20-/m1/s1