2-chloranyl-1,7-dimethyl-5H-purin-7-ium-6-one

Systemtic Name: 2-chloranyl-1,7-dimethyl-5H-purin-7-ium-6-one Openeye Name: 2-chloro-1,7-dimethyl-5H-purin-7-ium-6-one CAS Name: 2-chloro-1,7-dimethyl-5H-purin-7-ium-6-one IUPAC Name: 2-chloro-1,7-dimethyl-5H-purin-7-ium-6-one Traditional Name: 2-chloro-1,7-dimethyl-5H-purin-7-ium-6-one Formula: C7H8ClN4O+ MolecularWeight: 199.61762

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2C(=NC=[N+]2C)N=C1Cl

Isomeric SMILES

CN1C(=O)C2C(=NC=[N+]2C)N=C1Cl

InChI

InChI=1S/C7H8ClN4O/c1-11-3-9-5-4(11)6(13)12(2)7(8)10-5/h3-4H,1-2H3/q+1