2-azanyl-9-oxidanidyl-7-prop-2-enyl-3H-purin-9-ium-6-one

Systemtic Name: 2-azanyl-9-oxidanidyl-7-prop-2-enyl-3H-purin-9-ium-6-one Openeye Name: 7-allyl-2-amino-9-oxido-3H-purin-9-ium-6-one CAS Name: 2-amino-9-oxido-7-prop-2-enyl-3H-purin-9-ium-6-one IUPAC Name: 2-amino-9-oxido-7-prop-2-enyl-3H-purin-9-ium-6-one Traditional Name: 7-allyl-2-amino-9-oxido-3H-purin-9-ium-6-one Formula: C8H9N5O2 MolecularWeight: 207.18936

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=[N+](C2=C1C(=O)N=C(N2)N)[O-]

Isomeric SMILES

C=CCN1C=[N+](C2=C1C(=O)N=C(N2)N)[O-]

InChI

InChI=1S/C8H9N5O2/c1-2-3-12-4-13(15)6-5(12)7(14)11-8(9)10-6/h2,4H,1,3H2,(H3,9,10,11,14)