4-nitro-1H-pyrrolo[2,3-b]pyridine; piperazine-1,2-dicarboxamide

Systemtic Name: 4-nitro-1H-pyrrolo[2,3-b]pyridine; piperazine-1,2-dicarboxamide Openeye Name: 4-nitro-1H-pyrrolo[2,3-b]pyridine; piperazine-1,2-dicarboxamide CAS Name: 4-nitro-1H-pyrrolo[2,3-b]pyridine; piperazine-1,2-dicarboxamide IUPAC Name: 4-nitro-1H-pyrrolo[2,3-b]pyridine; piperazine-1,2-dicarboxamide Traditional Name: 4-nitro-1H-pyrrolo[2,3-b]pyridine; piperazine-1,2-dicarboxamide Formula: C13H17N7O4 MolecularWeight: 335.31858

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)C(=O)N)C(=O)N.C1=CNC2=NC=CC(=C21)[N+](=O)[O-]

Isomeric SMILES

C1CN(C(CN1)C(=O)N)C(=O)N.C1=CNC2=NC=CC(=C21)[N+](=O)[O-]

InChI

InChI=1S/C7H5N3O2.C6H12N4O2/c11-10(12)6-2-4-9-7-5(6)1-3-8-7;7-5(11)4-3-9-1-2-10(4)6(8)12/h1-4H,(H,8,9);4,9H,1-3H2,(H2,7,11)(H2,8,12)