2-[3-(2-azanyl-7H-purin-6-yl)phenyl]ethylazanium

Systemtic Name: 2-[3-(2-azanyl-7H-purin-6-yl)phenyl]ethylazanium Openeye Name: 2-[3-(2-amino-7H-purin-6-yl)phenyl]ethylammonium CAS Name: 2-[3-(2-amino-7H-purin-6-yl)phenyl]ethylammonium IUPAC Name: 2-[3-(2-amino-7H-purin-6-yl)phenyl]ethylazanium Traditional Name: 2-[3-(2-amino-7H-purin-6-yl)phenyl]ethylammonium Formula: C13H15N6+ MolecularWeight: 255.2984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CC[NH3+])C2=C3C(=NC(=N2)N)N=CN3

Isomeric SMILES

C1=CC(=CC(=C1)CC[NH3+])C2=C3C(=NC(=N2)N)N=CN3

InChI

InChI=1S/C13H14N6/c14-5-4-8-2-1-3-9(6-8)10-11-12(17-7-16-11)19-13(15)18-10/h1-3,6-7H,4-5,14H2,(H3,15,16,17,18,19)/p+1