2-hydroxyethyl-dimethyl-[2-(6-phenylazanylpurin-9-yl)ethyl]azanium hydrobromide

Systemtic Name: 2-hydroxyethyl-dimethyl-[2-(6-phenylazanylpurin-9-yl)ethyl]azanium hydrobromide Openeye Name: 2-(6-anilinopurin-9-yl)ethyl-(2-hydroxyethyl)-dimethyl-ammonium hydrobromide CAS Name: 2-(6-anilino-9-purinyl)ethyl-(2-hydroxyethyl)-dimethylammonium hydrobromide IUPAC Name: 2-(6-anilinopurin-9-yl)ethyl-(2-hydroxyethyl)-dimethylazanium hydrobromide Traditional Name: 2-(6-anilinopurin-9-yl)ethyl-(2-hydroxyethyl)-dimethyl-ammonium hydrobromide Formula: C17H24BrN6O+ MolecularWeight: 408.31606

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCN1C=NC2=C1N=CN=C2NC3=CC=CC=C3)CCO.Br

Isomeric SMILES

C[N+](C)(CCN1C=NC2=C1N=CN=C2NC3=CC=CC=C3)CCO.Br

InChI

InChI=1S/C17H23N6O.BrH/c1-23(2,10-11-24)9-8-22-13-20-15-16(18-12-19-17(15)22)21-14-6-4-3-5-7-14;/h3-7,12-13,24H,8-11H2,1-2H3,(H,18,19,21);1H/q+1;