1-[2-(6-aminopurin-9-yl)ethyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[2-(6-aminopurin-9-yl)ethyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[2-(6-aminopurin-9-yl)ethyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[2-(6-aminopurin-9-yl)ethyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[2-(6-aminopurin-9-yl)ethyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-(2-adenin-9-ylethyl)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)CCN2C=NC3=C2N=CN=C3N)C(=O)N

Isomeric SMILES

C1=CC(=C[N+](=C1)CCN2C=NC3=C2N=CN=C3N)C(=O)N

InChI

InChI=1S/C13H13N7O/c14-11-10-13(17-7-16-11)20(8-18-10)5-4-19-3-1-2-9(6-19)12(15)21/h1-3,6-8H,4-5H2,(H3-,14,15,16,17,21)/p+1