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

Systemtic Name: 9-(3-methoxyphenyl)-2-(2-nitrophenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 9-(3-methoxyphenyl)-2-(2-nitrophenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 9-(3-methoxyphenyl)-2-(2-nitrophenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 9-(3-methoxyphenyl)-2-(2-nitrophenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 8-keto-9-(3-methoxyphenyl)-2-(2-nitrophenyl)-7H-purine-6-carboxamide Formula: C19H14N6O5 MolecularWeight: 406.35166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C19H14N6O5/c1-30-11-6-4-5-10(9-11)24-18-15(22-19(24)27)14(16(20)26)21-17(23-18)12-7-2-3-8-13(12)25(28)29/h2-9H,1H3,(H2,20,26)(H,22,27)