2-[(3-nitrophenyl)methylideneamino]-3,7-dihydropurin-6-one

Systemtic Name: 2-[(3-nitrophenyl)methylideneamino]-3,7-dihydropurin-6-one Openeye Name: 2-[(3-nitrophenyl)methyleneamino]-3,7-dihydropurin-6-one CAS Name: 2-[(3-nitrophenyl)methylideneamino]-3,7-dihydropurin-6-one IUPAC Name: 2-[(3-nitrophenyl)methylideneamino]-3,7-dihydropurin-6-one Traditional Name: 2-[(3-nitrobenzylidene)amino]-3,7-dihydropurin-6-one Formula: C12H8N6O3 MolecularWeight: 284.23032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=NC2=NC(=O)C3=C(N2)N=CN3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C=NC2=NC(=O)C3=C(N2)N=CN3

InChI

InChI=1S/C12H8N6O3/c19-11-9-10(15-6-14-9)16-12(17-11)13-5-7-2-1-3-8(4-7)18(20)21/h1-6H,(H2,14,15,16,17,19)