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1-[2-(6-azanyl-7H-purin-2-yl)ethyl]pyridin-1-ium-3-carboxamide

1-[2-(6-azanyl-7H-purin-2-yl)ethyl]pyridin-1-ium-3-carboxamide

Systemtic Name:1-[2-(6-azanyl-7H-purin-2-yl)ethyl]pyridin-1-ium-3-carboxamide
Openeye Name:1-[2-(6-amino-7H-purin-2-yl)ethyl]pyridin-1-ium-3-carboxamide
CAS Name:1-[2-(6-amino-7H-purin-2-yl)ethyl]-3-pyridin-1-iumcarboxamide
IUPAC Name:1-[2-(6-amino-7H-purin-2-yl)ethyl]pyridin-1-ium-3-carboxamide
Traditional Name:1-[2-(6-amino-7H-purin-2-yl)ethyl]pyridin-1-ium-3-carboxamide
Formula: C13H14N7O+
MolecularWeight: 284.29656
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)CCC2=NC3=C(C(=N2)N)NC=N3)C(=O)N


Isomeric SMILES

C1=CC(=C[N+](=C1)CCC2=NC3=C(C(=N2)N)NC=N3)C(=O)N


InChI

InChI=1S/C13H13N7O/c14-11-10-13(17-7-16-10)19-9(18-11)3-5-20-4-1-2-8(6-20)12(15)21/h1-2,4,6-7H,3,5H2,(H4-,14,15,16,17,18,19,21)/p+1


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