5-bromanyl-7-[(4-phenylpiperazin-1-ium-1-yl)methyl]quinolin-8-ol

Systemtic Name: 5-bromanyl-7-[(4-phenylpiperazin-1-ium-1-yl)methyl]quinolin-8-ol Openeye Name: 5-bromo-7-[(4-phenylpiperazin-1-ium-1-yl)methyl]quinolin-8-ol CAS Name: 5-bromo-7-[(4-phenyl-1-piperazin-1-iumyl)methyl]-8-quinolinol IUPAC Name: 5-bromo-7-[(4-phenylpiperazin-1-ium-1-yl)methyl]quinolin-8-ol Traditional Name: 5-bromo-7-[(4-phenylpiperazin-1-ium-1-yl)methyl]quinolin-8-ol Formula: C20H21BrN3O+ MolecularWeight: 399.30424

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=C3C=CC=NC3=C2O)Br)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=C3C=CC=NC3=C2O)Br)C4=CC=CC=C4

InChI

InChI=1S/C20H20BrN3O/c21-18-13-15(20(25)19-17(18)7-4-8-22-19)14-23-9-11-24(12-10-23)16-5-2-1-3-6-16/h1-8,13,25H,9-12,14H2/p+1