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

Systemtic Name: 9-(3-methylphenyl)-2-(4-nitrophenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 9-(m-tolyl)-2-(4-nitrophenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 9-(3-methylphenyl)-2-(4-nitrophenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 9-(3-methylphenyl)-2-(4-nitrophenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 8-keto-9-(m-tolyl)-2-(4-nitrophenyl)-7H-purine-6-carboxamide Formula: C19H14N6O4 MolecularWeight: 390.35226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H14N6O4/c1-10-3-2-4-13(9-10)24-18-15(22-19(24)27)14(16(20)26)21-17(23-18)11-5-7-12(8-6-11)25(28)29/h2-9H,1H3,(H2,20,26)(H,22,27)