9-(3,4-dichlorophenyl)-2-(4-nitrophenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 9-(3,4-dichlorophenyl)-2-(4-nitrophenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 9-(3,4-dichlorophenyl)-2-(4-nitrophenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 9-(3,4-dichlorophenyl)-2-(4-nitrophenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 9-(3,4-dichlorophenyl)-2-(4-nitrophenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 9-(3,4-dichlorophenyl)-8-keto-2-(4-nitrophenyl)-7H-purine-6-carboxamide Formula: C18H10Cl2N6O4 MolecularWeight: 445.2158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC(=C(C=C4)Cl)Cl)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC(=C(C=C4)Cl)Cl)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H10Cl2N6O4/c19-11-6-5-10(7-12(11)20)25-17-14(23-18(25)28)13(15(21)27)22-16(24-17)8-1-3-9(4-2-8)26(29)30/h1-7H,(H2,21,27)(H,23,28)