1-(phenylmethyl)-7H-purin-6-one

Systemtic Name: 1-(phenylmethyl)-7H-purin-6-one Openeye Name: 1-benzyl-7H-purin-6-one CAS Name: 1-(phenylmethyl)-7H-purin-6-one IUPAC Name: 1-benzyl-7H-purin-6-one Traditional Name: 1-benzyl-7H-purin-6-one Formula: C12H10N4O MolecularWeight: 226.234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C(C2=O)NC=N3

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C(C2=O)NC=N3

InChI

InChI=1S/C12H10N4O/c17-12-10-11(14-7-13-10)15-8-16(12)6-9-4-2-1-3-5-9/h1-5,7-8H,6H2,(H,13,14)