2-(4-nitrophenyl)-3,7-dihydropurin-6-one

Systemtic Name: 2-(4-nitrophenyl)-3,7-dihydropurin-6-one Openeye Name: 2-(4-nitrophenyl)-3,7-dihydropurin-6-one CAS Name: 2-(4-nitrophenyl)-3,7-dihydropurin-6-one IUPAC Name: 2-(4-nitrophenyl)-3,7-dihydropurin-6-one Traditional Name: 2-(4-nitrophenyl)-3,7-dihydropurin-6-one Formula: C11H7N5O3 MolecularWeight: 257.20498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=O)C3=C(N2)N=CN3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=O)C3=C(N2)N=CN3)[N+](=O)[O-]

InChI

InChI=1S/C11H7N5O3/c17-11-8-10(13-5-12-8)14-9(15-11)6-1-3-7(4-2-6)16(18)19/h1-5H,(H2,12,13,14,15,17)