N-[9-(phenylmethyl)purin-6-yl]nitrous amide; sodium

Systemtic Name: N-[9-(phenylmethyl)purin-6-yl]nitrous amide; sodium Openeye Name: N-(9-benzylpurin-6-yl)nitrous amide; sodium CAS Name: N-[9-(phenylmethyl)-6-purinyl]nitrous amide; sodium IUPAC Name: N-(9-benzylpurin-6-yl)nitrous amide; sodium Traditional Name: N-(9-benzylpurin-6-yl)nitrous amide; sodium Formula: C12H10N6NaO MolecularWeight: 277.23717

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3NN=O.[Na]

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3NN=O.[Na]

InChI

InChI=1S/C12H10N6O.Na/c19-17-16-11-10-12(14-7-13-11)18(8-15-10)6-9-4-2-1-3-5-9;/h1-5,7-8H,6H2,(H,13,14,16,19);