5-bromanyl-7-[(4-ethylpiperazin-1-ium-1-yl)methyl]quinolin-8-olate

Systemtic Name: 5-bromanyl-7-[(4-ethylpiperazin-1-ium-1-yl)methyl]quinolin-8-olate Openeye Name: 5-bromo-7-[(4-ethylpiperazin-1-ium-1-yl)methyl]quinolin-8-olate CAS Name: 5-bromo-7-[(4-ethyl-1-piperazin-1-iumyl)methyl]-8-quinolinolate IUPAC Name: 5-bromo-7-[(4-ethylpiperazin-1-ium-1-yl)methyl]quinolin-8-olate Traditional Name: 5-bromo-7-[(4-ethylpiperazin-1-ium-1-yl)methyl]quinolin-8-olate Formula: C16H20BrN3O MolecularWeight: 350.2535

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[NH+](CC1)CC2=CC(=C3C=CC=NC3=C2[O-])Br

Isomeric SMILES

CCN1CC[NH+](CC1)CC2=CC(=C3C=CC=NC3=C2[O-])Br

InChI

InChI=1S/C16H20BrN3O/c1-2-19-6-8-20(9-7-19)11-12-10-14(17)13-4-3-5-18-15(13)16(12)21/h3-5,10,21H,2,6-9,11H2,1H3