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

Systemtic Name: [3-[3-[2,4-bis(oxidanylidene)quinazolin-1-yl]propanoylamino]phenyl]methyl-diethyl-azanium Openeye Name: [3-[3-(2,4-dioxoquinazolin-1-yl)propanoylamino]phenyl]methyl-diethyl-ammonium CAS Name: [3-[[3-(2,4-dioxo-1-quinazolinyl)-1-oxopropyl]amino]phenyl]methyl-diethylammonium IUPAC Name: [3-[3-(2,4-dioxoquinazolin-1-yl)propanoylamino]phenyl]methyl-diethylazanium Traditional Name: [3-[3-(2,4-diketoquinazolin-1-yl)propanoylamino]benzyl]-diethyl-ammonium Formula: C22H27N4O3+ MolecularWeight: 395.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC(=CC=C1)NC(=O)CCN2C3=CC=CC=C3C(=O)NC2=O

Isomeric SMILES

CC[NH+](CC)CC1=CC(=CC=C1)NC(=O)CCN2C3=CC=CC=C3C(=O)NC2=O

InChI

InChI=1S/C22H26N4O3/c1-3-25(4-2)15-16-8-7-9-17(14-16)23-20(27)12-13-26-19-11-6-5-10-18(19)21(28)24-22(26)29/h5-11,14H,3-4,12-13,15H2,1-2H3,(H,23,27)(H,24,28,29)/p+1