8-nitro-5-piperazin-4-ium-1-yl-quinoline

Systemtic Name: 8-nitro-5-piperazin-4-ium-1-yl-quinoline Openeye Name: 8-nitro-5-piperazin-4-ium-1-yl-quinoline CAS Name: 8-nitro-5-(1-piperazin-4-iumyl)quinoline IUPAC Name: 8-nitro-5-piperazin-4-ium-1-ylquinoline Traditional Name: 8-nitro-5-piperazin-4-ium-1-yl-quinoline Formula: C13H15N4O2+ MolecularWeight: 259.2838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=C3C=CC=NC3=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH2+]1)C2=C3C=CC=NC3=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O2/c18-17(19)12-4-3-11(16-8-6-14-7-9-16)10-2-1-5-15-13(10)12/h1-5,14H,6-9H2/p+1