dimethyl-[[2-[[3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoylamino]methyl]phenyl]methyl]azanium

Systemtic Name: dimethyl-[[2-[[3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoylamino]methyl]phenyl]methyl]azanium Openeye Name: dimethyl-[[2-[[3-(4-oxo-1H-quinazolin-2-yl)propanoylamino]methyl]phenyl]methyl]ammonium CAS Name: dimethyl-[[2-[[[1-oxo-3-(4-oxo-1H-quinazolin-2-yl)propyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: dimethyl-[[2-[[3-(4-oxo-1H-quinazolin-2-yl)propanoylamino]methyl]phenyl]methyl]azanium Traditional Name: [2-[[3-(4-keto-1H-quinazolin-2-yl)propanoylamino]methyl]benzyl]-dimethyl-ammonium Formula: C21H25N4O2+ MolecularWeight: 365.4488

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=CC=C1CNC(=O)CCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

C[NH+](C)CC1=CC=CC=C1CNC(=O)CCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C21H24N4O2/c1-25(2)14-16-8-4-3-7-15(16)13-22-20(26)12-11-19-23-18-10-6-5-9-17(18)21(27)24-19/h3-10H,11-14H2,1-2H3,(H,22,26)(H,23,24,27)/p+1