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

Systemtic Name: 2-azanyl-7-[(3-nitrophenyl)methyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one Openeye Name: 2-amino-7-[(3-nitrophenyl)methyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one CAS Name: 2-amino-7-[(3-nitrophenyl)methyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one IUPAC Name: 2-amino-7-[(3-nitrophenyl)methyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one Traditional Name: 2-amino-7-(3-nitrobenzyl)-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one Formula: C13H11N5O3 MolecularWeight: 285.25814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CC2=CNC3=C2NC(=NC3=O)N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CC2=CNC3=C2NC(=NC3=O)N

InChI

InChI=1S/C13H11N5O3/c14-13-16-10-8(6-15-11(10)12(19)17-13)4-7-2-1-3-9(5-7)18(20)21/h1-3,5-6,15H,4H2,(H3,14,16,17,19)