[3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-[2-(dimethylamino)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: [3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-[2-(dimethylamino)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [3-(cyanomethyl)-4-oxo-quinazolin-2-yl]methyl-[2-(dimethylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [3-(cyanomethyl)-4-oxo-2-quinazolinyl]methyl-[2-(dimethylamino)-2-oxoethyl]-methylammonium IUPAC Name: [3-(cyanomethyl)-4-oxoquinazolin-2-yl]methyl-[2-(dimethylamino)-2-oxoethyl]-methylazanium Traditional Name: [3-(cyanomethyl)-4-keto-quinazolin-2-yl]methyl-[2-(dimethylamino)-2-keto-ethyl]-methyl-ammonium Formula: C16H20N5O2+ MolecularWeight: 314.3623

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=CC=CC=C2C(=O)N1CC#N)CC(=O)N(C)C

Isomeric SMILES

C[NH+](CC1=NC2=CC=CC=C2C(=O)N1CC#N)CC(=O)N(C)C

InChI

InChI=1S/C16H19N5O2/c1-19(2)15(22)11-20(3)10-14-18-13-7-5-4-6-12(13)16(23)21(14)9-8-17/h4-7H,9-11H2,1-3H3/p+1