2-[4-(5-nitroquinolin-8-yl)piperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-(5-nitroquinolin-8-yl)piperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-(5-nitro-8-quinolyl)piperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-(5-nitro-8-quinolinyl)-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-(5-nitroquinolin-8-yl)piperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-(5-nitro-8-quinolyl)piperazin-1-ium-1-yl]ethanol Formula: C15H19N4O3+ MolecularWeight: 303.33636

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCO)C2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3

Isomeric SMILES

C1CN(CC[NH+]1CCO)C2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3

InChI

InChI=1S/C15H18N4O3/c20-11-10-17-6-8-18(9-7-17)14-4-3-13(19(21)22)12-2-1-5-16-15(12)14/h1-5,20H,6-11H2/p+1