2-azanyl-7-(3-nitrophenyl)carbonyl-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one

Systemtic Name: 2-azanyl-7-(3-nitrophenyl)carbonyl-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one Openeye Name: 2-amino-7-(3-nitrobenzoyl)-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one CAS Name: 2-amino-7-[(3-nitrophenyl)-oxomethyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one IUPAC Name: 2-amino-7-(3-nitrobenzoyl)-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one Traditional Name: 2-amino-7-(3-nitrobenzoyl)-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one Formula: C13H9N5O4 MolecularWeight: 299.24166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)C2=CNC3=C2NC(=NC3=O)N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)C2=CNC3=C2NC(=NC3=O)N

InChI

InChI=1S/C13H9N5O4/c14-13-16-9-8(5-15-10(9)12(20)17-13)11(19)6-2-1-3-7(4-6)18(21)22/h1-5,15H,(H3,14,16,17,20)