9-(phenylmethyl)-3,7-dihydropurine-2,8-dione

Systemtic Name: 9-(phenylmethyl)-3,7-dihydropurine-2,8-dione Openeye Name: 9-benzyl-3,7-dihydropurine-2,8-dione CAS Name: 9-(phenylmethyl)-3,7-dihydropurine-2,8-dione IUPAC Name: 9-benzyl-3,7-dihydropurine-2,8-dione Traditional Name: 9-benzyl-3,7-dihydropurine-2,8-quinone Formula: C12H10N4O2 MolecularWeight: 242.2334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=NC(=O)N3)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=NC(=O)N3)NC2=O

InChI

InChI=1S/C12H10N4O2/c17-11-13-6-9-10(15-11)16(12(18)14-9)7-8-4-2-1-3-5-8/h1-6H,7H2,(H,14,18)(H,13,15,17)