7-[(4-methylpiperazine-1,4-diium-1-yl)-pyridin-1-ium-3-yl-methyl]quinolin-8-ol

Systemtic Name: 7-[(4-methylpiperazine-1,4-diium-1-yl)-pyridin-1-ium-3-yl-methyl]quinolin-8-ol Openeye Name: 7-[(4-methylpiperazine-1,4-diium-1-yl)-pyridin-1-ium-3-yl-methyl]quinolin-8-ol CAS Name: 7-[(4-methyl-1-piperazine-1,4-diiumyl)-(3-pyridin-1-iumyl)methyl]-8-quinolinol IUPAC Name: 7-[(4-methylpiperazine-1,4-diium-1-yl)-pyridin-1-ium-3-ylmethyl]quinolin-8-ol Traditional Name: 7-[(4-methylpiperazine-1,4-diium-1-yl)-pyridin-1-ium-3-yl-methyl]quinolin-8-ol Formula: C20H25N4O+3 MolecularWeight: 337.4387

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)C(C2=C[NH+]=CC=C2)C3=C(C4=C(C=CC=N4)C=C3)O

Isomeric SMILES

C[NH+]1CC[NH+](CC1)C(C2=C[NH+]=CC=C2)C3=C(C4=C(C=CC=N4)C=C3)O

InChI

InChI=1S/C20H22N4O/c1-23-10-12-24(13-11-23)19(16-5-2-8-21-14-16)17-7-6-15-4-3-9-22-18(15)20(17)25/h2-9,14,19,25H,10-13H2,1H3/p+3