2-azanyl-6-(4-pyrrolidin-1-ylpyridin-1-ium-1-yl)pyrimidin-4-olate

Systemtic Name: 2-azanyl-6-(4-pyrrolidin-1-ylpyridin-1-ium-1-yl)pyrimidin-4-olate Openeye Name: 2-amino-6-(4-pyrrolidin-1-ylpyridin-1-ium-1-yl)pyrimidin-4-olate CAS Name: 2-amino-6-[4-(1-pyrrolidinyl)-1-pyridin-1-iumyl]-4-pyrimidinolate IUPAC Name: 2-amino-6-(4-pyrrolidin-1-ylpyridin-1-ium-1-yl)pyrimidin-4-olate Traditional Name: 2-amino-6-(4-pyrrolidinopyridin-1-ium-1-yl)pyrimidin-4-olate Formula: C13H15N5O MolecularWeight: 257.2911

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=[N+](C=C2)C3=CC(=NC(=N3)N)[O-]

Isomeric SMILES

C1CCN(C1)C2=CC=[N+](C=C2)C3=CC(=NC(=N3)N)[O-]

InChI

InChI=1S/C13H15N5O/c14-13-15-11(9-12(19)16-13)18-7-3-10(4-8-18)17-5-1-2-6-17/h3-4,7-9H,1-2,5-6H2,(H2-,14,15,16,19)