7-[[4-[(8-oxidanylquinolin-7-yl)methyl]piperazin-1-ium-1-yl]methyl]quinolin-8-olate

Systemtic Name: 7-[[4-[(8-oxidanylquinolin-7-yl)methyl]piperazin-1-ium-1-yl]methyl]quinolin-8-olate Openeye Name: 7-[[4-[(8-hydroxy-7-quinolyl)methyl]piperazin-1-ium-1-yl]methyl]quinolin-8-olate CAS Name: 7-[[4-[(8-hydroxy-7-quinolinyl)methyl]-1-piperazin-1-iumyl]methyl]-8-quinolinolate IUPAC Name: 7-[[4-[(8-hydroxyquinolin-7-yl)methyl]piperazin-1-ium-1-yl]methyl]quinolin-8-olate Traditional Name: 7-[[4-[(8-hydroxy-7-quinolyl)methyl]piperazin-1-ium-1-yl]methyl]quinolin-8-olate Formula: C24H24N4O2 MolecularWeight: 400.47296

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(C3=C(C=CC=N3)C=C2)[O-])CC4=C(C5=C(C=CC=N5)C=C4)O

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C3=C(C=CC=N3)C=C2)[O-])CC4=C(C5=C(C=CC=N5)C=C4)O

InChI

InChI=1S/C24H24N4O2/c29-23-19(7-5-17-3-1-9-25-21(17)23)15-27-11-13-28(14-12-27)16-20-8-6-18-4-2-10-26-22(18)24(20)30/h1-10,29-30H,11-16H2