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

Systemtic Name: diethyl-[[4-[[3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoylamino]methyl]phenyl]methyl]azanium Openeye Name: diethyl-[[4-[[3-(4-oxo-1H-quinazolin-2-yl)propanoylamino]methyl]phenyl]methyl]ammonium CAS Name: diethyl-[[4-[[[1-oxo-3-(4-oxo-1H-quinazolin-2-yl)propyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: diethyl-[[4-[[3-(4-oxo-1H-quinazolin-2-yl)propanoylamino]methyl]phenyl]methyl]azanium Traditional Name: diethyl-[4-[[3-(4-keto-1H-quinazolin-2-yl)propanoylamino]methyl]benzyl]ammonium Formula: C23H29N4O2+ MolecularWeight: 393.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)CCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)CCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C23H28N4O2/c1-3-27(4-2)16-18-11-9-17(10-12-18)15-24-22(28)14-13-21-25-20-8-6-5-7-19(20)23(29)26-21/h5-12H,3-4,13-16H2,1-2H3,(H,24,28)(H,25,26,29)/p+1