3-[2,4-bis(oxidanylidene)-1H-benzo[g]pteridin-9-yl]propyl-dimethyl-azanium chloride

Systemtic Name: 3-[2,4-bis(oxidanylidene)-1H-benzo[g]pteridin-9-yl]propyl-dimethyl-azanium chloride Openeye Name: 3-(2,4-dioxo-1H-benzo[g]pteridin-9-yl)propyl-dimethyl-ammonium chloride CAS Name: 3-(2,4-dioxo-1H-benzo[g]pteridin-9-yl)propyl-dimethylammonium chloride IUPAC Name: 3-(2,4-dioxo-1H-benzo[g]pteridin-9-yl)propyl-dimethylazanium chloride Traditional Name: 3-(2,4-diketo-1H-benzo[g]pteridin-9-yl)propyl-dimethyl-ammonium chloride Formula: C15H18ClN5O2 MolecularWeight: 335.78872

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCC1=C2C(=CC=C1)N=C3C(=N2)NC(=O)NC3=O.[Cl-]

Isomeric SMILES

C[NH+](C)CCCC1=C2C(=CC=C1)N=C3C(=N2)NC(=O)NC3=O.[Cl-]

InChI

InChI=1S/C15H17N5O2.ClH/c1-20(2)8-4-6-9-5-3-7-10-11(9)17-13-12(16-10)14(21)19-15(22)18-13;/h3,5,7H,4,6,8H2,1-2H3,(H2,17,18,19,21,22);1H