6,8-dinitro-2-piperazin-1-yl-quinoline

Systemtic Name: 6,8-dinitro-2-piperazin-1-yl-quinoline Openeye Name: 6,8-dinitro-2-piperazin-1-yl-quinoline CAS Name: 6,8-dinitro-2-(1-piperazinyl)quinoline IUPAC Name: 6,8-dinitro-2-piperazin-1-ylquinoline Traditional Name: 6,8-dinitro-2-piperazino-quinoline Formula: C13H13N5O4 MolecularWeight: 303.27342

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC3=C(C=C(C=C3C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=NC3=C(C=C(C=C3C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H13N5O4/c19-17(20)10-7-9-1-2-12(16-5-3-14-4-6-16)15-13(9)11(8-10)18(21)22/h1-2,7-8,14H,3-6H2